(3S)-3-(3-chlorophenyl)-3-phenylpropanamide

C15H14ClNO — CID 125467279

IUPAC(3S)-3-(3-chlorophenyl)-3-phenylpropanamide
SMILESNC(=O)C[C@@H](c1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C15H14ClNO/c16-13-8-4-7-12(9-13)14(10-15(17)18)11-5-2-1-3-6-11/h1-9,14H,10H2,(H2,17,18)/t14-/m0/s1
InChIKeyVUJXPOSEOYJXOI-AWEZNQCLSA-N
MW259.74 g/mol
LogP3.35
Rot. Bonds4

About (3S)-3-(3-chlorophenyl)-3-phenylpropanamide

(3S)-3-(3-chlorophenyl)-3-phenylpropanamide (PubChem CID 125467279) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is (3S)-3-(3-chlorophenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(3S)-3-(3-chlorophenyl)-3-phenylpropanamide
PubChem CID125467279
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name(3S)-3-(3-chlorophenyl)-3-phenylpropanamide
SMILESNC(=O)C[C@@H](c1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C15H14ClNO/c16-13-8-4-7-12(9-13)14(10-15(17)18)11-5-2-1-3-6-11/h1-9,14H,10H2,(H2,17,18)/t14-/m0/s1
InChIKeyVUJXPOSEOYJXOI-AWEZNQCLSA-N
XLogP3.35
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (3S)-3-(3-chlorophenyl)-3-phenylpropanamide 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

(2R)-2-(3-chlorophenyl)butanediamide
CID 94675074
3-amino-3-(3-chlorophenyl)propanamide;hydrochloride
CID 122360252
(4S)-4-(3-chlorophenyl)-4-phenylbutanoic acid
CID 129383494
(3S)-3-(3-chlorophenyl)-1-phenylpentan-1-one
CID 58517183
(3R)-3-(3-chlorophenyl)-1-(4-methylpiperazin-1-yl)-3-phenylpropan-1-one
CID 29021819
3-(3-chlorophenyl)-3-phenylpropanal
CID 19076021
3-(3-chlorophenyl)-N-(2-methoxyethyl)-3-phenylpropanamide
CID 45193216
(2R)-2-amino-2-(3-chlorophenyl)acetamide
CID 11286873
(2R)-4-amino-2-[1-(3-chlorophenyl)ethylcarbamoylamino]-4-oxobutanoic acid
CID 107826878
(2S)-4-amino-2-[1-(3-chlorophenyl)ethylcarbamoylamino]-4-oxobutanoic acid
CID 63718308
3-(3-chlorophenyl)butanoic acid
CID 71683749
3-amino-3-(3-chlorophenyl)propanoate
CID 22608540

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(3-chlorophenyl)-3-phenylpropanamide?
The IUPAC name of (3S)-3-(3-chlorophenyl)-3-phenylpropanamide (CID 125467279) is (3S)-3-(3-chlorophenyl)-3-phenylpropanamide.
What is the SMILES notation for (3S)-3-(3-chlorophenyl)-3-phenylpropanamide?
The canonical SMILES for (3S)-3-(3-chlorophenyl)-3-phenylpropanamide is NC(=O)C[C@@H](c1ccccc1)c1cccc(Cl)c1.
What is the InChIKey of (3S)-3-(3-chlorophenyl)-3-phenylpropanamide?
The InChIKey is VUJXPOSEOYJXOI-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H14ClNO/c16-13-8-4-7-12(9-13)14(10-15(17)18)11-5-2-1-3-6-11/h1-9,14H,10H2,(H2,17,18)/t14-/m0/s1.
What are the key properties of (3S)-3-(3-chlorophenyl)-3-phenylpropanamide?
(3S)-3-(3-chlorophenyl)-3-phenylpropanamide has a molecular weight of 259.74 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(3-chlorophenyl)-3-phenylpropanamide is sourced from PubChem (CID 125467279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).