2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide

C23H22N2O2 — CID 1210513

IUPAC2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide
SMILESC[C@H](NC(=O)c1ccccc1NC(=O)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C23H22N2O2/c1-17(19-12-6-3-7-13-19)24-23(27)20-14-8-9-15-21(20)25-22(26)16-18-10-4-2-5-11-18/h2-15,17H,16H2,1H3,(H,24,27)(H,25,26)/t17-/m0/s1
InChIKeyXIIRHOPQRSUBQU-KRWDZBQOSA-N
MW358.44 g/mol
LogP4.36
Rot. Bonds6

About 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide

2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide (PubChem CID 1210513) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide
PubChem CID1210513
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide
SMILESC[C@H](NC(=O)c1ccccc1NC(=O)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C23H22N2O2/c1-17(19-12-6-3-7-13-19)24-23(27)20-14-8-9-15-21(20)25-22(26)16-18-10-4-2-5-11-18/h2-15,17H,16H2,1H3,(H,24,27)(H,25,26)/t17-/m0/s1
InChIKeyXIIRHOPQRSUBQU-KRWDZBQOSA-N
XLogP4.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-phenylethyl]-2-[[2-(4-phenylphenyl)acetyl]amino]benzamide
CID 100515353
2-[[2-(4-aminophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54795752
2-[[2-(2-methylphenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 16557303
2-(3-chloropropanoylamino)-N-(1-phenylethyl)benzamide
CID 4157890
2-(hexanoylamino)-N-[(1S)-1-phenylethyl]benzamide
CID 9240215
2-[3-(4-fluorophenyl)propanoylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 92540792
2-[3-(4-fluorophenyl)propanoylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 92540793
2-phenylethyl 4-oxo-4-[2-(1-phenylethylcarbamoyl)anilino]butanoate
CID 4946844
2-hydrazinyl-N-(1-phenylethyl)benzamide
CID 62248479
2-[[2-[benzoyl(methyl)amino]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 42949097
2-[3-(2,6-dichlorophenyl)propanoylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 100600751
2-[[2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 42913741

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide?
The IUPAC name of 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide (CID 1210513) is 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide.
What is the SMILES notation for 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide?
The canonical SMILES for 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide is C[C@H](NC(=O)c1ccccc1NC(=O)Cc1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide?
The InChIKey is XIIRHOPQRSUBQU-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-17(19-12-6-3-7-13-19)24-23(27)20-14-8-9-15-21(20)25-22(26)16-18-10-4-2-5-11-18/h2-15,17H,16H2,1H3,(H,24,27)(H,25,26)/t17-/m0/s1.
What are the key properties of 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide?
2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide has a molecular weight of 358.44 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylacetyl)amino]-N-[(1S)-1-phenylethyl]benzamide is sourced from PubChem (CID 1210513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).