2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid

C14H11ClN2O4 — CID 125473172

IUPAC2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(-c2ccc(Cl)cc2)[nH]c1=O
InChIInChI=1S/C14H11ClN2O4/c15-9-3-1-8(2-4-9)11-6-5-10(14(21)17-11)13(20)16-7-12(18)19/h1-6H,7H2,(H,16,20)(H,17,21)(H,18,19)
InChIKeyGKHJUZJNSABYLC-UHFFFAOYSA-N
MW306.71 g/mol
LogP1.51
Rot. Bonds4

About 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid

2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid (PubChem CID 125473172) has the molecular formula C14H11ClN2O4 and a molecular weight of 306.71 g/mol. Its IUPAC name is 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid
PubChem CID125473172
Molecular FormulaC14H11ClN2O4
Molecular Weight306.71 g/mol
Exact Mass306.04
IUPAC Name2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(-c2ccc(Cl)cc2)[nH]c1=O
InChIInChI=1S/C14H11ClN2O4/c15-9-3-1-8(2-4-9)11-6-5-10(14(21)17-11)13(20)16-7-12(18)19/h1-6H,7H2,(H,16,20)(H,17,21)(H,18,19)
InChIKeyGKHJUZJNSABYLC-UHFFFAOYSA-N
XLogP1.51
TPSA99.26 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.71
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid?
The IUPAC name of 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid (CID 125473172) is 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid is O=C(O)CNC(=O)c1ccc(-c2ccc(Cl)cc2)[nH]c1=O.
What is the InChIKey of 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid?
The InChIKey is GKHJUZJNSABYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O4/c15-9-3-1-8(2-4-9)11-6-5-10(14(21)17-11)13(20)16-7-12(18)19/h1-6H,7H2,(H,16,20)(H,17,21)(H,18,19).
What are the key properties of 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid?
2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid has a molecular weight of 306.71 g/mol, XLogP of 1.51, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid is sourced from PubChem (CID 125473172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).