2-(5-amino-2-oxo-1-pyridinyl)acetic acid

C7H8N2O3 — CID 28924751

IUPAC2-(5-amino-2-oxo-1-pyridinyl)acetic acid
SMILESNc1ccc(=O)n(CC(=O)O)c1
InChIInChI=1S/C7H8N2O3/c8-5-1-2-6(10)9(3-5)4-7(11)12/h1-3H,4,8H2,(H,11,12)
InChIKeyQQJBXJVXQUBYIP-UHFFFAOYSA-N
MW168.15 g/mol
LogP-0.48
Rot. Bonds2

About 2-(5-amino-2-oxo-1-pyridinyl)acetic acid

2-(5-amino-2-oxo-1-pyridinyl)acetic acid (PubChem CID 28924751) has the molecular formula C7H8N2O3 and a molecular weight of 168.15 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)acetic acid.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)acetic acid
PubChem CID28924751
Molecular FormulaC7H8N2O3
Molecular Weight168.15 g/mol
Exact Mass168.05
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)acetic acid
SMILESNc1ccc(=O)n(CC(=O)O)c1
InChIInChI=1S/C7H8N2O3/c8-5-1-2-6(10)9(3-5)4-7(11)12/h1-3H,4,8H2,(H,11,12)
InChIKeyQQJBXJVXQUBYIP-UHFFFAOYSA-N
XLogP-0.48
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)acetic acid?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)acetic acid (CID 28924751) is 2-(5-amino-2-oxo-1-pyridinyl)acetic acid.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)acetic acid?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)acetic acid is Nc1ccc(=O)n(CC(=O)O)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)acetic acid?
The InChIKey is QQJBXJVXQUBYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3/c8-5-1-2-6(10)9(3-5)4-7(11)12/h1-3H,4,8H2,(H,11,12).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)acetic acid?
2-(5-amino-2-oxo-1-pyridinyl)acetic acid has a molecular weight of 168.15 g/mol, XLogP of -0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)acetic acid is sourced from PubChem (CID 28924751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).