N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide

C24H25ClN2O — CID 24953415

IUPACN-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide
SMILESCN(C)CC[C@H](NC(=O)c1cccc(-c2ccccc2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C24H25ClN2O/c1-27(2)16-15-23(19-11-13-22(25)14-12-19)26-24(28)21-10-6-9-20(17-21)18-7-4-3-5-8-18/h3-14,17,23H,15-16H2,1-2H3,(H,26,28)/t23-/m0/s1
InChIKeyAXFZVYLWUMGJDH-QHCPKHFHSA-N
MW392.93 g/mol
LogP5.43
Rot. Bonds7

About N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide

N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide (PubChem CID 24953415) has the molecular formula C24H25ClN2O and a molecular weight of 392.93 g/mol. Its IUPAC name is N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide
PubChem CID24953415
Molecular FormulaC24H25ClN2O
Molecular Weight392.93 g/mol
Exact Mass392.17
IUPAC NameN-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide
SMILESCN(C)CC[C@H](NC(=O)c1cccc(-c2ccccc2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C24H25ClN2O/c1-27(2)16-15-23(19-11-13-22(25)14-12-19)26-24(28)21-10-6-9-20(17-21)18-7-4-3-5-8-18/h3-14,17,23H,15-16H2,1-2H3,(H,26,28)/t23-/m0/s1
InChIKeyAXFZVYLWUMGJDH-QHCPKHFHSA-N
XLogP5.43
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.93
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide 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

N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-naphthalen-2-ylbenzamide
CID 24953762
N-[(1S)-3-(dimethylamino)-1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 24954832
4-(4-chlorophenyl)-N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]benzamide;hydrochloride
CID 45481577
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-(tetrazol-1-yl)benzamide
CID 110278520
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 110278637
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide
CID 110278628
3-(4-chlorophenyl)-N-[3-(4-chlorophenyl)-3-(dimethylamino)propyl]benzamide
CID 69166105
2-(4-chlorophenyl)-N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]acetamide
CID 110278648
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052
N-[7-(dimethylamino)-1-phenylheptyl]benzamide
CID 3027100
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]cyclobutanecarboxamide
CID 110278622
3-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]benzamide
CID 110281663

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide?
The IUPAC name of N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide (CID 24953415) is N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide.
What is the SMILES notation for N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide?
The canonical SMILES for N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide is CN(C)CC[C@H](NC(=O)c1cccc(-c2ccccc2)c1)c1ccc(Cl)cc1.
What is the InChIKey of N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide?
The InChIKey is AXFZVYLWUMGJDH-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H25ClN2O/c1-27(2)16-15-23(19-11-13-22(25)14-12-19)26-24(28)21-10-6-9-20(17-21)18-7-4-3-5-8-18/h3-14,17,23H,15-16H2,1-2H3,(H,26,28)/t23-/m0/s1.
What are the key properties of N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide?
N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide has a molecular weight of 392.93 g/mol, XLogP of 5.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide is sourced from PubChem (CID 24953415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).