N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide

C15H13N3O — CID 110864606

IUPACN-(2-cyanophenyl)-3-pyridin-3-ylpropanamide
SMILESN#Cc1ccccc1NC(=O)CCc1cccnc1
InChIInChI=1S/C15H13N3O/c16-10-13-5-1-2-6-14(13)18-15(19)8-7-12-4-3-9-17-11-12/h1-6,9,11H,7-8H2,(H,18,19)
InChIKeyOUFQENGRFHGZBA-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.52
Rot. Bonds4

About N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide

N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide (PubChem CID 110864606) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-3-pyridin-3-ylpropanamide
PubChem CID110864606
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC NameN-(2-cyanophenyl)-3-pyridin-3-ylpropanamide
SMILESN#Cc1ccccc1NC(=O)CCc1cccnc1
InChIInChI=1S/C15H13N3O/c16-10-13-5-1-2-6-14(13)18-15(19)8-7-12-4-3-9-17-11-12/h1-6,9,11H,7-8H2,(H,18,19)
InChIKeyOUFQENGRFHGZBA-UHFFFAOYSA-N
XLogP2.52
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-4-(2-cyanoanilino)-4-oxo-2-(pyridin-3-ylmethylamino)butanoic acid
CID 7592387
N-methyl-2-(3-pyridin-3-ylpropanoylamino)benzamide
CID 34754830
N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
CID 112519927
N-(2-cyanophenyl)-3-hydroxypropanamide
CID 43165059
3-pyridin-3-yl-N-(2-pyrrolidin-1-ylphenyl)propanamide
CID 30583465
N-[4-(4-cyanophenoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 48872559
N-(2-cyanophenyl)-4-pyrazin-2-ylsulfanylbutanamide
CID 63380899
N-[5-(2-cyanoanilino)-2-pyridinyl]-3-phenylpropanamide
CID 113037072
N-[2-(3-methoxypropoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 86830197
N-(2,6-dimethylphenyl)-2-(3-pyridin-3-ylpropanoylamino)benzamide
CID 46991790
N-[2-(3-aminoprop-1-ynyl)phenyl]-2-pyridin-3-ylacetamide
CID 62689712
methyl 2-hydroxy-3-(3-pyridin-3-ylpropanoylamino)benzoate
CID 56784435

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide (CID 110864606) is N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide is N#Cc1ccccc1NC(=O)CCc1cccnc1.
What is the InChIKey of N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide?
The InChIKey is OUFQENGRFHGZBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c16-10-13-5-1-2-6-14(13)18-15(19)8-7-12-4-3-9-17-11-12/h1-6,9,11H,7-8H2,(H,18,19).
What are the key properties of N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide?
N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide has a molecular weight of 251.29 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110864606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).