N-(2-cyanophenyl)-3-hydroxypropanamide

C10H10N2O2 — CID 43165059

IUPACN-(2-cyanophenyl)-3-hydroxypropanamide
SMILESN#Cc1ccccc1NC(=O)CCO
InChIInChI=1S/C10H10N2O2/c11-7-8-3-1-2-4-9(8)12-10(14)5-6-13/h1-4,13H,5-6H2,(H,12,14)
InChIKeyWRKRBFHXDLGHOI-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.88
Rot. Bonds3

About N-(2-cyanophenyl)-3-hydroxypropanamide

N-(2-cyanophenyl)-3-hydroxypropanamide (PubChem CID 43165059) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is N-(2-cyanophenyl)-3-hydroxypropanamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-3-hydroxypropanamide
PubChem CID43165059
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC NameN-(2-cyanophenyl)-3-hydroxypropanamide
SMILESN#Cc1ccccc1NC(=O)CCO
InChIInChI=1S/C10H10N2O2/c11-7-8-3-1-2-4-9(8)12-10(14)5-6-13/h1-4,13H,5-6H2,(H,12,14)
InChIKeyWRKRBFHXDLGHOI-UHFFFAOYSA-N
XLogP0.88
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanophenyl)-3-[5-hydroxypentyl(methyl)amino]propanamide
CID 107199658
N-(2-cyanophenyl)-2-(methylamino)acetamide
CID 24697085
methyl 9-(2-cyanoanilino)-9-oxononanoate
CID 169087837
N-(2-cyanophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740419
N-(2-cyanophenyl)-N'-(2-fluorophenyl)propanediamide
CID 108954791
ethyl 3-(2-cyanoanilino)-3-oxopropanoate
CID 14663489
3-(4-cyanoanilino)-N-(2-cyanophenyl)propanamide
CID 109042807
6-amino-N-(2-cyanophenyl)-4,4-dimethylhexanamide
CID 65292791
(2-cyanophenyl)urea
CID 13155570
N-(2-cyanophenyl)-3-[3-(dimethylamino)propyl-methylamino]propanamide
CID 63694009
3-(4-chloroanilino)-N-(2-cyanophenyl)propanamide
CID 109038248
2-[[3-(2-cyanoanilino)-3-oxopropyl]amino]-2-methylpropanoic acid
CID 65263681

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-3-hydroxypropanamide?
The IUPAC name of N-(2-cyanophenyl)-3-hydroxypropanamide (CID 43165059) is N-(2-cyanophenyl)-3-hydroxypropanamide.
What is the SMILES notation for N-(2-cyanophenyl)-3-hydroxypropanamide?
The canonical SMILES for N-(2-cyanophenyl)-3-hydroxypropanamide is N#Cc1ccccc1NC(=O)CCO.
What is the InChIKey of N-(2-cyanophenyl)-3-hydroxypropanamide?
The InChIKey is WRKRBFHXDLGHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c11-7-8-3-1-2-4-9(8)12-10(14)5-6-13/h1-4,13H,5-6H2,(H,12,14).
What are the key properties of N-(2-cyanophenyl)-3-hydroxypropanamide?
N-(2-cyanophenyl)-3-hydroxypropanamide has a molecular weight of 190.20 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-3-hydroxypropanamide is sourced from PubChem (CID 43165059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).