2-(3-acetamidophenoxy)pyridine-3-carboxylic acid

C14H12N2O4 — CID 22612378

IUPAC2-(3-acetamidophenoxy)pyridine-3-carboxylic acid
SMILESCC(=O)Nc1cccc(Oc2ncccc2C(=O)O)c1
InChIInChI=1S/C14H12N2O4/c1-9(17)16-10-4-2-5-11(8-10)20-13-12(14(18)19)6-3-7-15-13/h2-8H,1H3,(H,16,17)(H,18,19)
InChIKeyIXYJMVDZWDJZJR-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.53
Rot. Bonds4

About 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid

2-(3-acetamidophenoxy)pyridine-3-carboxylic acid (PubChem CID 22612378) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(3-acetamidophenoxy)pyridine-3-carboxylic acid
PubChem CID22612378
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name2-(3-acetamidophenoxy)pyridine-3-carboxylic acid
SMILESCC(=O)Nc1cccc(Oc2ncccc2C(=O)O)c1
InChIInChI=1S/C14H12N2O4/c1-9(17)16-10-4-2-5-11(8-10)20-13-12(14(18)19)6-3-7-15-13/h2-8H,1H3,(H,16,17)(H,18,19)
InChIKeyIXYJMVDZWDJZJR-UHFFFAOYSA-N
XLogP2.53
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-carbamoylphenoxy)pyridine-3-carboxylic acid
CID 24704749
N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513585
2-(3-acetamidophenyl)pyridine-3-carboxylic acid
CID 53223643
2-naphthalen-2-yloxypyridine-3-carboxylic acid
CID 16784651
2-[4-(3-acetylphenyl)phenoxy]pyridine-3-carboxylic acid
CID 11681522
2-(4-fluorophenoxy)pyridine-3-carboxylic acid
CID 605123
1-[2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]ethanone
CID 170916930
2-(4-chlorophenoxy)pyridine-3-carboxylic acid
CID 609454
2-(2,3-dimethoxyphenoxy)pyridine-3-carboxylic acid
CID 46779210
2-(2-oxopropoxy)pyridine-3-carboxylic acid
CID 89326483
2-(4-bromo-3-fluorophenoxy)pyridine-3-carboxylic acid
CID 65203992
ethyl 2-[3-[(4-propoxybenzoyl)amino]phenoxy]pyridine-3-carboxylate
CID 44764821

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid?
The IUPAC name of 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid (CID 22612378) is 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid is CC(=O)Nc1cccc(Oc2ncccc2C(=O)O)c1.
What is the InChIKey of 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid?
The InChIKey is IXYJMVDZWDJZJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c1-9(17)16-10-4-2-5-11(8-10)20-13-12(14(18)19)6-3-7-15-13/h2-8H,1H3,(H,16,17)(H,18,19).
What are the key properties of 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid?
2-(3-acetamidophenoxy)pyridine-3-carboxylic acid has a molecular weight of 272.26 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidophenoxy)pyridine-3-carboxylic acid is sourced from PubChem (CID 22612378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).