2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid

C9H10N2O4 — CID 24706014

IUPAC2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C9H10N2O4/c1-11(5-7(12)13)9(15)6-3-2-4-10-8(6)14/h2-4H,5H2,1H3,(H,10,14)(H,12,13)
InChIKeyQAQWCCGZLMIIMR-UHFFFAOYSA-N
MW210.19 g/mol
LogP-0.47
Rot. Bonds3

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

2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid (PubChem CID 24706014) has the molecular formula C9H10N2O4 and a molecular weight of 210.19 g/mol. Its IUPAC name is 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid
PubChem CID24706014
Molecular FormulaC9H10N2O4
Molecular Weight210.19 g/mol
Exact Mass210.06
IUPAC Name2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C9H10N2O4/c1-11(5-7(12)13)9(15)6-3-2-4-10-8(6)14/h2-4H,5H2,1H3,(H,10,14)(H,12,13)
InChIKeyQAQWCCGZLMIIMR-UHFFFAOYSA-N
XLogP-0.47
TPSA90.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid?
The IUPAC name of 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid (CID 24706014) is 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid is CN(CC(=O)O)C(=O)c1ccc[nH]c1=O.
What is the InChIKey of 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid?
The InChIKey is QAQWCCGZLMIIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O4/c1-11(5-7(12)13)9(15)6-3-2-4-10-8(6)14/h2-4H,5H2,1H3,(H,10,14)(H,12,13).
What are the key properties of 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid?
2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid has a molecular weight of 210.19 g/mol, XLogP of -0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-oxo-1H-pyridine-3-carbonyl)amino]acetic acid is sourced from PubChem (CID 24706014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).