6-acetamido-2-phenylpyridine-3-carboxylic acid

C14H12N2O3 — CID 68503657

IUPAC6-acetamido-2-phenylpyridine-3-carboxylic acid
SMILESCC(=O)Nc1ccc(C(=O)O)c(-c2ccccc2)n1
InChIInChI=1S/C14H12N2O3/c1-9(17)15-12-8-7-11(14(18)19)13(16-12)10-5-3-2-4-6-10/h2-8H,1H3,(H,18,19)(H,15,16,17)
InChIKeyZUBFYWCZDWBIEE-UHFFFAOYSA-N
MW256.26 g/mol
LogP2.41
Rot. Bonds3

About 6-acetamido-2-phenylpyridine-3-carboxylic acid

6-acetamido-2-phenylpyridine-3-carboxylic acid (PubChem CID 68503657) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is 6-acetamido-2-phenylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-acetamido-2-phenylpyridine-3-carboxylic acid
PubChem CID68503657
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC Name6-acetamido-2-phenylpyridine-3-carboxylic acid
SMILESCC(=O)Nc1ccc(C(=O)O)c(-c2ccccc2)n1
InChIInChI=1S/C14H12N2O3/c1-9(17)15-12-8-7-11(14(18)19)13(16-12)10-5-3-2-4-6-10/h2-8H,1H3,(H,18,19)(H,15,16,17)
InChIKeyZUBFYWCZDWBIEE-UHFFFAOYSA-N
XLogP2.41
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-acetamido-2-phenylpyridine-3-carboxylic acid?
The IUPAC name of 6-acetamido-2-phenylpyridine-3-carboxylic acid (CID 68503657) is 6-acetamido-2-phenylpyridine-3-carboxylic acid.
What is the SMILES notation for 6-acetamido-2-phenylpyridine-3-carboxylic acid?
The canonical SMILES for 6-acetamido-2-phenylpyridine-3-carboxylic acid is CC(=O)Nc1ccc(C(=O)O)c(-c2ccccc2)n1.
What is the InChIKey of 6-acetamido-2-phenylpyridine-3-carboxylic acid?
The InChIKey is ZUBFYWCZDWBIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3/c1-9(17)15-12-8-7-11(14(18)19)13(16-12)10-5-3-2-4-6-10/h2-8H,1H3,(H,18,19)(H,15,16,17).
What are the key properties of 6-acetamido-2-phenylpyridine-3-carboxylic acid?
6-acetamido-2-phenylpyridine-3-carboxylic acid has a molecular weight of 256.26 g/mol, XLogP of 2.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetamido-2-phenylpyridine-3-carboxylic acid is sourced from PubChem (CID 68503657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).