N-Acetylputrescine

Details

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Internal ID d7f1af2e-d385-434f-a26e-31abd3e42807
Taxonomy Organic acids and derivatives > Carboximidic acids and derivatives > Carboximidic acids
IUPAC Name N-(4-aminobutyl)acetamide
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C6H14N2O/c1-6(9)8-5-3-2-4-7/h2-5,7H2,1H3,(H,8,9)
InChI Key KLZGKIDSEJWEDW-UHFFFAOYSA-N
Popularity 292 references in papers

Physical and Chemical Properties

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Molecular Formula C6H14N2O
Molecular Weight 130.19 g/mol
Exact Mass 130.110613074 g/mol
Topological Polar Surface Area (TPSA) 55.10 Ų
XlogP -0.70

Synonyms

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N-(4-aminobutyl)acetamide
5699-41-2
Acetylputrescine
Acetamide, N-(4-aminobutyl)-
Putrescine, N-acetyl-
8FTM5ZL5A6
CHEMBL81241
CHEBI:17768
MFCD10024834
monoacetylputrescine
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of N-Acetylputrescine

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
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.18% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 92.53% 91.11%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 91.27% 97.21%
CHEMBL2581 P07339 Cathepsin D 89.25% 98.95%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 88.41% 96.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.90% 99.17%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 85.88% 97.29%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 84.99% 94.33%
CHEMBL3401 O75469 Pregnane X receptor 80.99% 94.73%

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 122356
LOTUS LTS0125543
wikiData Q27102595