2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid

C15H11ClFNO3 — CID 63723434

IUPAC2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid
SMILESO=C(Cc1ccccc1F)Nc1cccc(Cl)c1C(=O)O
InChIInChI=1S/C15H11ClFNO3/c16-10-5-3-7-12(14(10)15(20)21)18-13(19)8-9-4-1-2-6-11(9)17/h1-7H,8H2,(H,18,19)(H,20,21)
InChIKeyNFFZFLJFTKPUCS-UHFFFAOYSA-N
MW307.71 g/mol
LogP3.36
Rot. Bonds4

About 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid

2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid (PubChem CID 63723434) has the molecular formula C15H11ClFNO3 and a molecular weight of 307.71 g/mol. Its IUPAC name is 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid.

Molecular Properties

Compound Name2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid
PubChem CID63723434
Molecular FormulaC15H11ClFNO3
Molecular Weight307.71 g/mol
Exact Mass307.04
IUPAC Name2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid
SMILESO=C(Cc1ccccc1F)Nc1cccc(Cl)c1C(=O)O
InChIInChI=1S/C15H11ClFNO3/c16-10-5-3-7-12(14(10)15(20)21)18-13(19)8-9-4-1-2-6-11(9)17/h1-7H,8H2,(H,18,19)(H,20,21)
InChIKeyNFFZFLJFTKPUCS-UHFFFAOYSA-N
XLogP3.36
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.71
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-2-(2-fluorophenyl)acetamide
CID 2671408
2-chloro-6-[[2-(4-chlorophenyl)acetyl]amino]benzoic acid
CID 63724266
2-(2-fluorophenyl)-N-naphthalen-1-ylacetamide
CID 836511
2-(4-aminobutanoylamino)-6-chlorobenzoic acid
CID 63722595
2-chloro-6-(3-phenylpropanoylamino)benzoic acid
CID 63723256
N'-(2,3-dichlorophenyl)-N-[(2-fluorophenyl)methyl]propanediamide
CID 108946354
N-(2-chlorophenyl)-3-(2-fluorophenyl)propanamide
CID 9401009
2-chloro-6-[(2-methylsulfanylacetyl)amino]benzoic acid
CID 63724953
2-(6-aminohexanoylamino)-6-chlorobenzoic acid
CID 63724633
3-[[2-(2-fluorophenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 104740235
2-(2-fluorophenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 7492204
2-(2-chloro-6-fluorophenyl)-N-(2-ethylphenyl)acetamide
CID 839109

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid?
The IUPAC name of 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid (CID 63723434) is 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid.
What is the SMILES notation for 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid?
The canonical SMILES for 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid is O=C(Cc1ccccc1F)Nc1cccc(Cl)c1C(=O)O.
What is the InChIKey of 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid?
The InChIKey is NFFZFLJFTKPUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFNO3/c16-10-5-3-7-12(14(10)15(20)21)18-13(19)8-9-4-1-2-6-11(9)17/h1-7H,8H2,(H,18,19)(H,20,21).
What are the key properties of 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid?
2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid has a molecular weight of 307.71 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid is sourced from PubChem (CID 63723434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).