4-amino-1-(2-methoxyethyl)pyridin-2-one

C8H12N2O2 — CID 86276954

IUPAC4-amino-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCn1ccc(N)cc1=O
InChIInChI=1S/C8H12N2O2/c1-12-5-4-10-3-2-7(9)6-8(10)11/h2-3,6H,4-5,9H2,1H3
InChIKeyWITQMTUBUJHVSW-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.08
Rot. Bonds3

About 4-amino-1-(2-methoxyethyl)pyridin-2-one

4-amino-1-(2-methoxyethyl)pyridin-2-one (PubChem CID 86276954) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 4-amino-1-(2-methoxyethyl)pyridin-2-one.

Molecular Properties

Compound Name4-amino-1-(2-methoxyethyl)pyridin-2-one
PubChem CID86276954
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name4-amino-1-(2-methoxyethyl)pyridin-2-one
SMILESCOCCn1ccc(N)cc1=O
InChIInChI=1S/C8H12N2O2/c1-12-5-4-10-3-2-7(9)6-8(10)11/h2-3,6H,4-5,9H2,1H3
InChIKeyWITQMTUBUJHVSW-UHFFFAOYSA-N
XLogP0.08
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-amino-1-(2-methoxyethyl)pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(2-methoxyethyl)pyridin-2-one?
The IUPAC name of 4-amino-1-(2-methoxyethyl)pyridin-2-one (CID 86276954) is 4-amino-1-(2-methoxyethyl)pyridin-2-one.
What is the SMILES notation for 4-amino-1-(2-methoxyethyl)pyridin-2-one?
The canonical SMILES for 4-amino-1-(2-methoxyethyl)pyridin-2-one is COCCn1ccc(N)cc1=O.
What is the InChIKey of 4-amino-1-(2-methoxyethyl)pyridin-2-one?
The InChIKey is WITQMTUBUJHVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-12-5-4-10-3-2-7(9)6-8(10)11/h2-3,6H,4-5,9H2,1H3.
What are the key properties of 4-amino-1-(2-methoxyethyl)pyridin-2-one?
4-amino-1-(2-methoxyethyl)pyridin-2-one has a molecular weight of 168.20 g/mol, XLogP of 0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(2-methoxyethyl)pyridin-2-one is sourced from PubChem (CID 86276954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).