Tridecylamine

Details

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Internal ID 6d25d5b9-d95b-410b-9e43-cb5cb0e5ed7f
Taxonomy Organic nitrogen compounds > Organonitrogen compounds > Amines > Primary amines > Monoalkylamines
IUPAC Name tridecan-1-amine
SMILES (Canonical) CCCCCCCCCCCCCN
SMILES (Isomeric) CCCCCCCCCCCCCN
InChI InChI=1S/C13H29N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-14H2,1H3
InChI Key ABVVEAHYODGCLZ-UHFFFAOYSA-N
Popularity 50 references in papers

Physical and Chemical Properties

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Molecular Formula C13H29N
Molecular Weight 199.38 g/mol
Exact Mass 199.229999929 g/mol
Topological Polar Surface Area (TPSA) 26.00 Ų
XlogP 5.80

Synonyms

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Tridecylamine
1-Tridecanamine
2869-34-3
tridecan-1-amine
n-Tridecylamine
Tridecanamine
Monotridecylamine
5S0KQ9WZ2D
1-Tridecylamine
MFCD00008156
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Tridecylamine

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
CHEMBL1963 P16473 Thyroid stimulating hormone receptor 15.8 nM
Potency
via Super-PRED

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL2885 P07451 Carbonic anhydrase III 94.80% 87.45%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 93.10% 92.86%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 92.56% 97.29%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.46% 96.09%
CHEMBL230 P35354 Cyclooxygenase-2 90.11% 89.63%
CHEMBL2996 Q05655 Protein kinase C delta 88.10% 97.79%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 87.83% 92.08%
CHEMBL4581 P52732 Kinesin-like protein 1 87.80% 93.18%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 87.19% 85.94%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.41% 99.17%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 85.35% 96.95%
CHEMBL2581 P07339 Cathepsin D 84.80% 98.95%
CHEMBL3038469 P24941 CDK2/Cyclin A 81.44% 91.38%
CHEMBL3230 O95977 Sphingosine 1-phosphate receptor Edg-6 80.53% 94.01%
CHEMBL221 P23219 Cyclooxygenase-1 80.29% 90.17%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 40761
LOTUS LTS0213057
wikiData Q27262797