3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one

C15H22N2O3 — CID 62372154

IUPAC3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC(CCO)C2)c(=O)[nH]1
InChIInChI=1S/C15H22N2O3/c1-10-8-11(2)16-14(19)13(10)15(20)17-6-3-4-12(9-17)5-7-18/h8,12,18H,3-7,9H2,1-2H3,(H,16,19)
InChIKeyRQEMBOMVJRXJKT-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.23
Rot. Bonds3

About 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one

3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one (PubChem CID 62372154) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one
PubChem CID62372154
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC(CCO)C2)c(=O)[nH]1
InChIInChI=1S/C15H22N2O3/c1-10-8-11(2)16-14(19)13(10)15(20)17-6-3-4-12(9-17)5-7-18/h8,12,18H,3-7,9H2,1-2H3,(H,16,19)
InChIKeyRQEMBOMVJRXJKT-UHFFFAOYSA-N
XLogP1.23
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-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 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one?
The IUPAC name of 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one (CID 62372154) is 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one.
What is the SMILES notation for 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one?
The canonical SMILES for 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one is Cc1cc(C)c(C(=O)N2CCCC(CCO)C2)c(=O)[nH]1.
What is the InChIKey of 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one?
The InChIKey is RQEMBOMVJRXJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10-8-11(2)16-14(19)13(10)15(20)17-6-3-4-12(9-17)5-7-18/h8,12,18H,3-7,9H2,1-2H3,(H,16,19).
What are the key properties of 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one?
3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one has a molecular weight of 278.35 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one is sourced from PubChem (CID 62372154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).