2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide

C24H26N2O — CID 46631037

IUPAC2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)NC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O/c1-18-13-15-20(16-14-18)17-25-24(27)19(2)26-23(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,19,23,26H,17H2,1-2H3,(H,25,27)
InChIKeyWTPWUZBIVMNVTN-UHFFFAOYSA-N
MW358.49 g/mol
LogP4.38
Rot. Bonds7

About 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide

2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 46631037) has the molecular formula C24H26N2O and a molecular weight of 358.49 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide
PubChem CID46631037
Molecular FormulaC24H26N2O
Molecular Weight358.49 g/mol
Exact Mass358.20
IUPAC Name2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)NC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O/c1-18-13-15-20(16-14-18)17-25-24(27)19(2)26-23(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,19,23,26H,17H2,1-2H3,(H,25,27)
InChIKeyWTPWUZBIVMNVTN-UHFFFAOYSA-N
XLogP4.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]propanamide
CID 8640135
2-(benzhydrylamino)-N-[(3,4-dimethoxyphenyl)methyl]propanamide
CID 46631034
(2R)-2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide
CID 6543594
(2S)-2-(benzhydrylamino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 9445893
(2S)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-[(4-methoxyphenyl)methyl]propanamide
CID 8755264
2-cyano-N-[(4-methylphenyl)methyl]-2-phenylacetamide
CID 62878754
(2R)-2-[[(1R)-2-amino-2-oxo-1-phenylethyl]amino]-N-benzylpropanamide
CID 95582096
2-cyclopropyl-N-[(4-methylphenyl)methyl]-2-phenylacetamide
CID 110409297
(2R)-2-(benzhydrylamino)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 9445831
(2R)-N-[(4-methylphenyl)methyl]-2-phenoxypropanamide
CID 670065
2-[(4-methylphenyl)methylamino]-2-phenylacetic acid
CID 55036353
(2R)-2-(3-methylanilino)-N-[(4-methylphenyl)methyl]propanamide
CID 51925493

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide (CID 46631037) is 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide is Cc1ccc(CNC(=O)C(C)NC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is WTPWUZBIVMNVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O/c1-18-13-15-20(16-14-18)17-25-24(27)19(2)26-23(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,19,23,26H,17H2,1-2H3,(H,25,27).
What are the key properties of 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide?
2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 358.49 g/mol, XLogP of 4.38, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 46631037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).