(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide

C24H24N2O2 — CID 7516109

IUPAC(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@H](C)NC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-17(24(28)26-22-15-13-19(14-16-22)18(2)27)25-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-17,23,25H,1-2H3,(H,26,28)/t17-/m0/s1
InChIKeyLCJDLORHHBJWEB-KRWDZBQOSA-N
MW372.47 g/mol
LogP4.60
Rot. Bonds7

About (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide

(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide (PubChem CID 7516109) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide.

Molecular Properties

Compound Name(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide
PubChem CID7516109
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide
SMILESCC(=O)c1ccc(NC(=O)[C@H](C)NC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-17(24(28)26-22-15-13-19(14-16-22)18(2)27)25-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-17,23,25H,1-2H3,(H,26,28)/t17-/m0/s1
InChIKeyLCJDLORHHBJWEB-KRWDZBQOSA-N
XLogP4.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
CID 7971112
(2R)-N-(4-acetylphenyl)-2-amino-2-phenylacetamide
CID 61259858
(2R)-N-(4-acetylphenyl)-2-(2-phenylethylamino)propanamide
CID 2437197
4-[[(2S)-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]propanoyl]amino]benzamide
CID 9051191
(2S)-2-(benzhydrylamino)-N-(3,4-dimethoxyphenyl)propanamide
CID 9445871
(2S)-2-(benzhydrylamino)-N-(3-fluorophenyl)propanamide
CID 9445795
(2S)-N-(3-acetylphenyl)-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 8898640
N-(4-acetylphenyl)-3-amino-2-phenylpropanamide
CID 62877329
(2R)-N-(4-acetylphenyl)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]propanamide
CID 8918884
(2S)-2-[[(R)-(4-chlorophenyl)-phenylmethyl]amino]-N-(4-sulfamoylphenyl)propanamide
CID 41095619
[(2S)-1-(4-acetylanilino)-1-oxopropan-2-yl] (2R)-2-hydroxy-2-phenylacetate
CID 7821160
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
CID 8545508

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide?
The IUPAC name of (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide (CID 7516109) is (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide.
What is the SMILES notation for (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide?
The canonical SMILES for (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide is CC(=O)c1ccc(NC(=O)[C@H](C)NC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide?
The InChIKey is LCJDLORHHBJWEB-KRWDZBQOSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-17(24(28)26-22-15-13-19(14-16-22)18(2)27)25-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-17,23,25H,1-2H3,(H,26,28)/t17-/m0/s1.
What are the key properties of (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide?
(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide has a molecular weight of 372.47 g/mol, XLogP of 4.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide is sourced from PubChem (CID 7516109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).