4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one

C13H18N2O3 — CID 86285401

IUPAC4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one
SMILESCOC1CCN(C(=O)c2cc(C)[nH]c(=O)c2)CC1
InChIInChI=1S/C13H18N2O3/c1-9-7-10(8-12(16)14-9)13(17)15-5-3-11(18-2)4-6-15/h7-8,11H,3-6H2,1-2H3,(H,14,16)
InChIKeyVCFQXFZUNNIVHT-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.93
Rot. Bonds2

About 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one

4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one (PubChem CID 86285401) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one
PubChem CID86285401
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one
SMILESCOC1CCN(C(=O)c2cc(C)[nH]c(=O)c2)CC1
InChIInChI=1S/C13H18N2O3/c1-9-7-10(8-12(16)14-9)13(17)15-5-3-11(18-2)4-6-15/h7-8,11H,3-6H2,1-2H3,(H,14,16)
InChIKeyVCFQXFZUNNIVHT-UHFFFAOYSA-N
XLogP0.93
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-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 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one?
The IUPAC name of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one (CID 86285401) is 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one.
What is the SMILES notation for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one?
The canonical SMILES for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one is COC1CCN(C(=O)c2cc(C)[nH]c(=O)c2)CC1.
What is the InChIKey of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one?
The InChIKey is VCFQXFZUNNIVHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-9-7-10(8-12(16)14-9)13(17)15-5-3-11(18-2)4-6-15/h7-8,11H,3-6H2,1-2H3,(H,14,16).
What are the key properties of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one?
4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one has a molecular weight of 250.30 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyridin-2-one is sourced from PubChem (CID 86285401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).