2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid

C15H12ClNO3 — CID 17296977

IUPAC2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid
SMILESO=C(Cc1ccccc1Cl)Nc1ccccc1C(=O)O
InChIInChI=1S/C15H12ClNO3/c16-12-7-3-1-5-10(12)9-14(18)17-13-8-4-2-6-11(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)
InChIKeyXRDJDLUDUFIATH-UHFFFAOYSA-N
MW289.72 g/mol
LogP3.22
Rot. Bonds4

About 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid

2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid (PubChem CID 17296977) has the molecular formula C15H12ClNO3 and a molecular weight of 289.72 g/mol. Its IUPAC name is 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid.

Molecular Properties

Compound Name2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid
PubChem CID17296977
Molecular FormulaC15H12ClNO3
Molecular Weight289.72 g/mol
Exact Mass289.05
IUPAC Name2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid
SMILESO=C(Cc1ccccc1Cl)Nc1ccccc1C(=O)O
InChIInChI=1S/C15H12ClNO3/c16-12-7-3-1-5-10(12)9-14(18)17-13-8-4-2-6-11(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)
InChIKeyXRDJDLUDUFIATH-UHFFFAOYSA-N
XLogP3.22
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-benzoylphenyl)-2-(2-chlorophenyl)acetamide
CID 100633810
2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide
CID 43106968
N-[(2R)-butan-2-yl]-2-[[2-(2-chlorophenyl)acetyl]amino]benzamide
CID 26706384
2-[[2-(2-chlorophenyl)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29456122
2-(2-chlorophenyl)-N-(2-phenylphenyl)acetamide
CID 26727185
2-[[2-[(2-phenylacetyl)amino]benzoyl]amino]benzoic acid
CID 54761803
2-[[2-(2-chlorophenyl)acetyl]amino]benzenesulfonyl fluoride
CID 116814199
2-[(3-chloro-2-hydroxyphenyl)methylamino]benzoic acid
CID 112606376
2-[2-(2-chloro-4-iodoanilino)-2-oxoethyl]benzoic acid
CID 104601404
3-amino-4-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid
CID 63117383
2-[[4-chloro-3-[(2-phenylacetyl)amino]benzoyl]amino]benzoic acid
CID 17361903
N-(4-amino-2-chlorophenyl)-2-(2-chlorophenyl)acetamide
CID 18069719

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid?
The IUPAC name of 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid (CID 17296977) is 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid.
What is the SMILES notation for 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid?
The canonical SMILES for 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid is O=C(Cc1ccccc1Cl)Nc1ccccc1C(=O)O.
What is the InChIKey of 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid?
The InChIKey is XRDJDLUDUFIATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO3/c16-12-7-3-1-5-10(12)9-14(18)17-13-8-4-2-6-11(13)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20).
What are the key properties of 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid?
2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid has a molecular weight of 289.72 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid is sourced from PubChem (CID 17296977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).