3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one

C14H20N2O3 — CID 115874809

IUPAC3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC(C)(O)C2)c(=O)[nH]1
InChIInChI=1S/C14H20N2O3/c1-9-7-10(2)15-12(17)11(9)13(18)16-6-4-5-14(3,19)8-16/h7,19H,4-6,8H2,1-3H3,(H,15,17)
InChIKeyIDVVYPFZJBPCGF-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.98
Rot. Bonds1

About 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one

3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one (PubChem CID 115874809) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one
PubChem CID115874809
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC(C)(O)C2)c(=O)[nH]1
InChIInChI=1S/C14H20N2O3/c1-9-7-10(2)15-12(17)11(9)13(18)16-6-4-5-14(3,19)8-16/h7,19H,4-6,8H2,1-3H3,(H,15,17)
InChIKeyIDVVYPFZJBPCGF-UHFFFAOYSA-N
XLogP0.98
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(3-hydroxy-3-methylpiperidine-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-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one?
The IUPAC name of 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one (CID 115874809) is 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one.
What is the SMILES notation for 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one?
The canonical SMILES for 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one is Cc1cc(C)c(C(=O)N2CCCC(C)(O)C2)c(=O)[nH]1.
What is the InChIKey of 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one?
The InChIKey is IDVVYPFZJBPCGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9-7-10(2)15-12(17)11(9)13(18)16-6-4-5-14(3,19)8-16/h7,19H,4-6,8H2,1-3H3,(H,15,17).
What are the key properties of 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one?
3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one has a molecular weight of 264.32 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-3-methylpiperidine-1-carbonyl)-4,6-dimethyl-1H-pyridin-2-one is sourced from PubChem (CID 115874809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).