3-amino-3H-pyridin-2-one

C5H6N2O — CID 13143765

IUPAC3-amino-3H-pyridin-2-one
SMILESNC1C=CC=NC1=O
InChIInChI=1S/C5H6N2O/c6-4-2-1-3-7-5(4)8/h1-4H,6H2
InChIKeyFPNTYAIOUIINOJ-UHFFFAOYSA-N
MW110.12 g/mol
LogP-0.52
Rot. Bonds

About 3-amino-3H-pyridin-2-one

3-amino-3H-pyridin-2-one (PubChem CID 13143765) has the molecular formula C5H6N2O and a molecular weight of 110.12 g/mol. Its IUPAC name is 3-amino-3H-pyridin-2-one.

Molecular Properties

Compound Name3-amino-3H-pyridin-2-one
PubChem CID13143765
Molecular FormulaC5H6N2O
Molecular Weight110.12 g/mol
Exact Mass110.05
IUPAC Name3-amino-3H-pyridin-2-one
SMILESNC1C=CC=NC1=O
InChIInChI=1S/C5H6N2O/c6-4-2-1-3-7-5(4)8/h1-4H,6H2
InChIKeyFPNTYAIOUIINOJ-UHFFFAOYSA-N
XLogP-0.52
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.12
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3H-pyridin-2-one?
The IUPAC name of 3-amino-3H-pyridin-2-one (CID 13143765) is 3-amino-3H-pyridin-2-one.
What is the SMILES notation for 3-amino-3H-pyridin-2-one?
The canonical SMILES for 3-amino-3H-pyridin-2-one is NC1C=CC=NC1=O.
What is the InChIKey of 3-amino-3H-pyridin-2-one?
The InChIKey is FPNTYAIOUIINOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O/c6-4-2-1-3-7-5(4)8/h1-4H,6H2.
What are the key properties of 3-amino-3H-pyridin-2-one?
3-amino-3H-pyridin-2-one has a molecular weight of 110.12 g/mol, XLogP of -0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3H-pyridin-2-one is sourced from PubChem (CID 13143765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).