4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide

C29H26N2O2 — CID 3732499

IUPAC4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide
SMILESCC(CNC(=O)c1ccc(-c2ccccc2)cc1)NC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C29H26N2O2/c1-21(31-29(33)27-18-14-25(15-19-27)23-10-6-3-7-11-23)20-30-28(32)26-16-12-24(13-17-26)22-8-4-2-5-9-22/h2-19,21H,20H2,1H3,(H,30,32)(H,31,33)
InChIKeyDTUZAKNXYOTZLL-UHFFFAOYSA-N
MW434.54 g/mol
LogP5.57
Rot. Bonds7

About 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide

4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide (PubChem CID 3732499) has the molecular formula C29H26N2O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide
PubChem CID3732499
Molecular FormulaC29H26N2O2
Molecular Weight434.54 g/mol
Exact Mass434.20
IUPAC Name4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide
SMILESCC(CNC(=O)c1ccc(-c2ccccc2)cc1)NC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C29H26N2O2/c1-21(31-29(33)27-18-14-25(15-19-27)23-10-6-3-7-11-23)20-30-28(32)26-16-12-24(13-17-26)22-8-4-2-5-9-22/h2-19,21H,20H2,1H3,(H,30,32)(H,31,33)
InChIKeyDTUZAKNXYOTZLL-UHFFFAOYSA-N
XLogP5.57
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.54
LogP ≤ 55.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylpropyl)-4-(4-phenylphenyl)benzamide
CID 145125410
N-(2-hydroxypropyl)-4-phenylbenzamide
CID 43391038
4-amino-N-[2-[(4-aminobenzoyl)amino]propyl]benzamide
CID 3100251
N-[2-benzamido-2-(4-phenylphenyl)ethyl]benzamide
CID 139256665
4-nitro-N-[(2S)-2-[(4-nitrobenzoyl)amino]propyl]benzamide
CID 7040519
N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]-4-phenylbenzamide
CID 175913500
4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157619
4-phenyl-N-[(2S)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157618
4-methyl-2-[(4-phenylbenzoyl)amino]pentanoic acid
CID 17380410
4-[(N-methylsulfonylanilino)methyl]-N-[2-[[4-[(N-methylsulfonylanilino)methyl]benzoyl]amino]propyl]benzamide
CID 3119032
N-[2-hydroxy-3-(hydroxyamino)-3-oxopropyl]-4-phenylbenzamide
CID 59697016
tert-butyl N-(1-benzamidopropan-2-yl)carbamate
CID 177434930

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide?
The IUPAC name of 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide (CID 3732499) is 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide.
What is the SMILES notation for 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide?
The canonical SMILES for 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide is CC(CNC(=O)c1ccc(-c2ccccc2)cc1)NC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide?
The InChIKey is DTUZAKNXYOTZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2O2/c1-21(31-29(33)27-18-14-25(15-19-27)23-10-6-3-7-11-23)20-30-28(32)26-16-12-24(13-17-26)22-8-4-2-5-9-22/h2-19,21H,20H2,1H3,(H,30,32)(H,31,33).
What are the key properties of 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide?
4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide has a molecular weight of 434.54 g/mol, XLogP of 5.57, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[2-[(4-phenylbenzoyl)amino]propyl]benzamide is sourced from PubChem (CID 3732499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).