5-amino-1H-pyridin-2-one

C5H6N2O — CID 818256

IUPAC5-amino-1H-pyridin-2-one
SMILESNc1ccc(=O)[nH]c1
InChIInChI=1S/C5H6N2O/c6-4-1-2-5(8)7-3-4/h1-3H,6H2,(H,7,8)
InChIKeyGDOIKKMNCIMDAO-UHFFFAOYSA-N
MW110.12 g/mol
LogP-0.04
Rot. Bonds

About 5-amino-1H-pyridin-2-one

5-amino-1H-pyridin-2-one (PubChem CID 818256) has the molecular formula C5H6N2O and a molecular weight of 110.12 g/mol. Its IUPAC name is 5-amino-1H-pyridin-2-one.

Molecular Properties

Compound Name5-amino-1H-pyridin-2-one
PubChem CID818256
Molecular FormulaC5H6N2O
Molecular Weight110.12 g/mol
Exact Mass110.05
IUPAC Name5-amino-1H-pyridin-2-one
SMILESNc1ccc(=O)[nH]c1
InChIInChI=1S/C5H6N2O/c6-4-1-2-5(8)7-3-4/h1-3H,6H2,(H,7,8)
InChIKeyGDOIKKMNCIMDAO-UHFFFAOYSA-N
XLogP-0.04
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.12
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1H-pyridin-2-one?
The IUPAC name of 5-amino-1H-pyridin-2-one (CID 818256) is 5-amino-1H-pyridin-2-one.
What is the SMILES notation for 5-amino-1H-pyridin-2-one?
The canonical SMILES for 5-amino-1H-pyridin-2-one is Nc1ccc(=O)[nH]c1.
What is the InChIKey of 5-amino-1H-pyridin-2-one?
The InChIKey is GDOIKKMNCIMDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O/c6-4-1-2-5(8)7-3-4/h1-3H,6H2,(H,7,8).
What are the key properties of 5-amino-1H-pyridin-2-one?
5-amino-1H-pyridin-2-one has a molecular weight of 110.12 g/mol, XLogP of -0.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1H-pyridin-2-one is sourced from PubChem (CID 818256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).