4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide

C15H15N3O2 — CID 22691729

IUPAC4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)[C@@H](N)c2ccccc2)cc1
InChIInChI=1S/C15H15N3O2/c16-13(10-4-2-1-3-5-10)15(20)18-12-8-6-11(7-9-12)14(17)19/h1-9,13H,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1
InChIKeyGHZULNJUEWFHJU-ZDUSSCGKSA-N
MW269.30 g/mol
LogP1.42
Rot. Bonds4

About 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide

4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide (PubChem CID 22691729) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide.

Molecular Properties

Compound Name4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide
PubChem CID22691729
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)[C@@H](N)c2ccccc2)cc1
InChIInChI=1S/C15H15N3O2/c16-13(10-4-2-1-3-5-10)15(20)18-12-8-6-11(7-9-12)14(17)19/h1-9,13H,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1
InChIKeyGHZULNJUEWFHJU-ZDUSSCGKSA-N
XLogP1.42
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(4-acetylphenyl)-2-amino-2-phenylacetamide
CID 61259858
2-amino-N-(4-chlorophenyl)-2-phenylacetamide
CID 24702199
4-[(2-methoxy-2-phenylacetyl)amino]benzamide
CID 2896452
2-amino-2-(4-fluorophenyl)-N-phenylacetamide
CID 123261896
3-[[(2S)-2-amino-2-phenylacetyl]amino]benzoic acid
CID 103868733
4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
CID 7971112
4-[(2-nitro-2-phenylacetyl)amino]benzamide
CID 175262505
4-[[(2S)-2-amino-2-phenylacetyl]amino]-2-chlorobenzamide
CID 104897353
5-[[(2S)-2-amino-2-phenylacetyl]amino]-2-chlorobenzamide
CID 104897291
(2S)-2-amino-N-[4-(2-aminoethyl)phenyl]-2-phenylacetamide
CID 67245807
(2R)-2-amino-N-(4-methylsulfonylphenyl)-2-phenylacetamide
CID 61148899
4-(1-amino-2-anilino-2-oxoethyl)-N-pyridin-4-ylbenzamide
CID 15982114

Frequently Asked Questions

What is the IUPAC name of 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide?
The IUPAC name of 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide (CID 22691729) is 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide.
What is the SMILES notation for 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide?
The canonical SMILES for 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide is NC(=O)c1ccc(NC(=O)[C@@H](N)c2ccccc2)cc1.
What is the InChIKey of 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide?
The InChIKey is GHZULNJUEWFHJU-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-13(10-4-2-1-3-5-10)15(20)18-12-8-6-11(7-9-12)14(17)19/h1-9,13H,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1.
What are the key properties of 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide?
4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide has a molecular weight of 269.30 g/mol, XLogP of 1.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide is sourced from PubChem (CID 22691729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).