N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide

C16H16N2O2 — CID 9209643

IUPACN-(3-acetylphenyl)-3-pyridin-3-ylpropanamide
SMILESCC(=O)c1cccc(NC(=O)CCc2cccnc2)c1
InChIInChI=1S/C16H16N2O2/c1-12(19)14-5-2-6-15(10-14)18-16(20)8-7-13-4-3-9-17-11-13/h2-6,9-11H,7-8H2,1H3,(H,18,20)
InChIKeySABCJGGWNDVDTM-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.86
Rot. Bonds5

About N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide

N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide (PubChem CID 9209643) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-pyridin-3-ylpropanamide
PubChem CID9209643
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(3-acetylphenyl)-3-pyridin-3-ylpropanamide
SMILESCC(=O)c1cccc(NC(=O)CCc2cccnc2)c1
InChIInChI=1S/C16H16N2O2/c1-12(19)14-5-2-6-15(10-14)18-16(20)8-7-13-4-3-9-17-11-13/h2-6,9-11H,7-8H2,1H3,(H,18,20)
InChIKeySABCJGGWNDVDTM-UHFFFAOYSA-N
XLogP2.86
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-acetylphenyl)-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

methyl 3-[2-[3-(3-pyridin-3-ylpropanoylamino)phenyl]ethynyl]benzoate
CID 134048158
N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide
CID 17360048
1-(3-acetylphenyl)-3-(pyridin-3-ylmethyl)thiourea
CID 970859
N-(3-acetylphenyl)-3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330455
N-(3-acetylphenyl)-3-(4-chlorophenyl)propanamide
CID 19220931
N-[3-(2-aminoethoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 81485538
N-[2-(3-acetylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705505
N-(4-iodophenyl)-3-pyridin-3-ylpropanamide
CID 9206675
3-[3-[(2-pyridin-3-ylacetyl)amino]phenyl]propanoic acid
CID 115339339
N-(3-acetylphenyl)-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
CID 109026236
5-N-(3-acetylphenyl)-3-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106065
N-(1-methylpyrazol-4-yl)-3-pyridin-3-ylpropanamide
CID 32605738

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide (CID 9209643) is N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide is CC(=O)c1cccc(NC(=O)CCc2cccnc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide?
The InChIKey is SABCJGGWNDVDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-12(19)14-5-2-6-15(10-14)18-16(20)8-7-13-4-3-9-17-11-13/h2-6,9-11H,7-8H2,1H3,(H,18,20).
What are the key properties of N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide?
N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide has a molecular weight of 268.32 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 9209643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).