4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide

C23H23N3O2 — CID 7971112

IUPAC4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C23H23N3O2/c1-16(23(28)26-20-14-12-19(13-15-20)22(24)27)25-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-16,21,25H,1H3,(H2,24,27)(H,26,28)/t16-/m1/s1
InChIKeyYZYDIQWBSCYZIN-MRXNPFEDSA-N
MW373.46 g/mol
LogP3.49
Rot. Bonds7

About 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide

4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide (PubChem CID 7971112) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide.

Molecular Properties

Compound Name4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
PubChem CID7971112
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C23H23N3O2/c1-16(23(28)26-20-14-12-19(13-15-20)22(24)27)25-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-16,21,25H,1H3,(H2,24,27)(H,26,28)/t16-/m1/s1
InChIKeyYZYDIQWBSCYZIN-MRXNPFEDSA-N
XLogP3.49
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(2S)-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]propanoyl]amino]benzamide
CID 9051191
(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide
CID 7516109
4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide
CID 22691729
4-[2-(4-phenylanilino)propanoylamino]benzamide
CID 78667343
(2S)-2-(benzhydrylamino)-N-(3,4-dimethoxyphenyl)propanamide
CID 9445871
4-[(2-methoxy-2-phenylacetyl)amino]benzamide
CID 2896452
(2S)-2-(benzhydrylamino)-N-(3-fluorophenyl)propanamide
CID 9445795
2-(benzhydrylamino)-N-carbamoylpropanamide
CID 42915569
4-[2-(carbamoylamino)propanoylamino]benzamide
CID 24640882
4-[2-(1-naphthalen-1-ylethylamino)propanoylamino]benzamide
CID 86976453
(2S)-2-[[(R)-(4-chlorophenyl)-phenylmethyl]amino]-N-(4-sulfamoylphenyl)propanamide
CID 41095619
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
CID 8545508

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide?
The IUPAC name of 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide (CID 7971112) is 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide.
What is the SMILES notation for 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide?
The canonical SMILES for 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide is C[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide?
The InChIKey is YZYDIQWBSCYZIN-MRXNPFEDSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-16(23(28)26-20-14-12-19(13-15-20)22(24)27)25-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-16,21,25H,1H3,(H2,24,27)(H,26,28)/t16-/m1/s1.
What are the key properties of 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide?
4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide has a molecular weight of 373.46 g/mol, XLogP of 3.49, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide is sourced from PubChem (CID 7971112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).