Isobutylhydroxylamine

Details

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Internal ID 718f5e25-8a55-42c7-a751-ed5b5e0364d4
Taxonomy Organic nitrogen compounds > Organonitrogen compounds > N-organohydroxylamines
IUPAC Name N-(2-methylpropyl)hydroxylamine
SMILES (Canonical) CC(C)CNO
SMILES (Isomeric) CC(C)CNO
InChI InChI=1S/C4H11NO/c1-4(2)3-5-6/h4-6H,3H2,1-2H3
InChI Key NDCGVLJXFQKXOF-UHFFFAOYSA-N
Popularity 12 references in papers

Physical and Chemical Properties

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Molecular Formula C4H11NO
Molecular Weight 89.14 g/mol
Exact Mass 89.084063974 g/mol
Topological Polar Surface Area (TPSA) 32.30 Ų
XlogP 0.60

Synonyms

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N-(2-methylpropyl)hydroxylamine
N-isobutylhydroxylamine
N-Hydroxy-2-methylpropanamine
N-hydroxy-2-methylpropan-1-amine
N-(2-methylpropyl)-hydroxylamine
hydroxyisobutylamine
c0935
N-hydroxyisobutylamine
N-(isobutyl)hydroxylamine
64930-17-2
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Isobutylhydroxylamine

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 90.51% 96.09%
CHEMBL2581 P07339 Cathepsin D 88.36% 98.95%
CHEMBL2885 P07451 Carbonic anhydrase III 83.26% 87.45%
CHEMBL4073 P09237 Matrix metalloproteinase 7 80.80% 97.56%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 80.46% 97.29%

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 9543329
LOTUS LTS0081053
wikiData Q27225301