2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid

C14H11FN2O3 — CID 43442825

IUPAC2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid
SMILESO=C(Cc1ccccn1)Nc1cccc(F)c1C(=O)O
InChIInChI=1S/C14H11FN2O3/c15-10-5-3-6-11(13(10)14(19)20)17-12(18)8-9-4-1-2-7-16-9/h1-7H,8H2,(H,17,18)(H,19,20)
InChIKeyYVHDFOCOKYWJCL-UHFFFAOYSA-N
MW274.25 g/mol
LogP2.10
Rot. Bonds4

About 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid

2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid (PubChem CID 43442825) has the molecular formula C14H11FN2O3 and a molecular weight of 274.25 g/mol. Its IUPAC name is 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid.

Molecular Properties

Compound Name2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid
PubChem CID43442825
Molecular FormulaC14H11FN2O3
Molecular Weight274.25 g/mol
Exact Mass274.08
IUPAC Name2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid
SMILESO=C(Cc1ccccn1)Nc1cccc(F)c1C(=O)O
InChIInChI=1S/C14H11FN2O3/c15-10-5-3-6-11(13(10)14(19)20)17-12(18)8-9-4-1-2-7-16-9/h1-7H,8H2,(H,17,18)(H,19,20)
InChIKeyYVHDFOCOKYWJCL-UHFFFAOYSA-N
XLogP2.10
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-6-(3-pyridin-2-ylpropanoylamino)benzoic acid
CID 114289600
N-(2-hydroxyphenyl)-2-pyridin-2-ylacetamide
CID 11746373
N-naphthalen-1-yl-2-pyridin-2-ylacetamide
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2-fluoro-6-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]benzoic acid
CID 43442748
N-(2,3-dimethylphenyl)-2-pyridin-2-ylacetamide
CID 110696972
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110696997
N-phenyl-2-pyridin-2-ylacetamide chloride
CID 21234777
N-(2-fluoro-5-phenoxyphenyl)-2-pyridin-2-ylacetamide
CID 175716132
N-(6-fluoro-2-pyridinyl)-2-pyridin-2-ylacetamide
CID 104820505
2-chloro-6-[[2-(2-fluorophenyl)acetyl]amino]benzoic acid
CID 63723434
N'-(2-fluorophenyl)-N-(pyridin-2-ylmethyl)propanediamide
CID 108947513
3-[[2-(2-fluorophenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 104740235

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid?
The IUPAC name of 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid (CID 43442825) is 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid.
What is the SMILES notation for 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid?
The canonical SMILES for 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid is O=C(Cc1ccccn1)Nc1cccc(F)c1C(=O)O.
What is the InChIKey of 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid?
The InChIKey is YVHDFOCOKYWJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O3/c15-10-5-3-6-11(13(10)14(19)20)17-12(18)8-9-4-1-2-7-16-9/h1-7H,8H2,(H,17,18)(H,19,20).
What are the key properties of 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid?
2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid has a molecular weight of 274.25 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-[(2-pyridin-2-ylacetyl)amino]benzoic acid is sourced from PubChem (CID 43442825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).