3-[(2-chloro-2-phenylacetyl)amino]benzamide

C15H13ClN2O2 — CID 43346587

IUPAC3-[(2-chloro-2-phenylacetyl)amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)C(Cl)c2ccccc2)c1
InChIInChI=1S/C15H13ClN2O2/c16-13(10-5-2-1-3-6-10)15(20)18-12-8-4-7-11(9-12)14(17)19/h1-9,13H,(H2,17,19)(H,18,20)
InChIKeyGUEJQXSTYZWLQZ-UHFFFAOYSA-N
MW288.73 g/mol
LogP2.70
Rot. Bonds4

About 3-[(2-chloro-2-phenylacetyl)amino]benzamide

3-[(2-chloro-2-phenylacetyl)amino]benzamide (PubChem CID 43346587) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is 3-[(2-chloro-2-phenylacetyl)amino]benzamide.

Molecular Properties

Compound Name3-[(2-chloro-2-phenylacetyl)amino]benzamide
PubChem CID43346587
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC Name3-[(2-chloro-2-phenylacetyl)amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)C(Cl)c2ccccc2)c1
InChIInChI=1S/C15H13ClN2O2/c16-13(10-5-2-1-3-6-10)15(20)18-12-8-4-7-11(9-12)14(17)19/h1-9,13H,(H2,17,19)(H,18,20)
InChIKeyGUEJQXSTYZWLQZ-UHFFFAOYSA-N
XLogP2.70
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-[(2-chloro-2-phenylacetyl)amino]-3-methylbenzamide
CID 43698893
3-[[(2R)-2-phenylpentanoyl]amino]benzamide
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3-(2-aminopropanoylamino)benzamide
CID 61258270
3-[[(2S)-2-amino-2-phenylacetyl]amino]benzoic acid
CID 103868733
2-chloro-2-phenyl-N-(3,4,5-trifluorophenyl)acetamide
CID 62811265
N-[2-(3-carbamoylanilino)-2-oxo-1-phenylethyl]thiophene-2-carboxamide
CID 24653858
(2S)-2-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-phenylacetamide
CID 40569777
(2R)-2-chloro-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide
CID 2392261
(2R)-N-(1,3-benzodioxol-5-yl)-2-chloro-2-phenylacetamide
CID 93239229
2-chloro-N-(2-methyl-1,3-benzothiazol-6-yl)-2-phenylacetamide
CID 43091108
N-(3-bromo-5-methylphenyl)-2-chloro-2-phenylacetamide
CID 107582669
3-[(3-propan-2-ylphenyl)carbamothioylamino]benzamide
CID 53365173

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chloro-2-phenylacetyl)amino]benzamide?
The IUPAC name of 3-[(2-chloro-2-phenylacetyl)amino]benzamide (CID 43346587) is 3-[(2-chloro-2-phenylacetyl)amino]benzamide.
What is the SMILES notation for 3-[(2-chloro-2-phenylacetyl)amino]benzamide?
The canonical SMILES for 3-[(2-chloro-2-phenylacetyl)amino]benzamide is NC(=O)c1cccc(NC(=O)C(Cl)c2ccccc2)c1.
What is the InChIKey of 3-[(2-chloro-2-phenylacetyl)amino]benzamide?
The InChIKey is GUEJQXSTYZWLQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c16-13(10-5-2-1-3-6-10)15(20)18-12-8-4-7-11(9-12)14(17)19/h1-9,13H,(H2,17,19)(H,18,20).
What are the key properties of 3-[(2-chloro-2-phenylacetyl)amino]benzamide?
3-[(2-chloro-2-phenylacetyl)amino]benzamide has a molecular weight of 288.73 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chloro-2-phenylacetyl)amino]benzamide is sourced from PubChem (CID 43346587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).