2-(6-methyl-2-pyridinyl)piperidin-4-one

C11H14N2O — CID 82403926

IUPAC2-(6-methyl-2-pyridinyl)piperidin-4-one
SMILESCc1cccc(C2CC(=O)CCN2)n1
InChIInChI=1S/C11H14N2O/c1-8-3-2-4-10(13-8)11-7-9(14)5-6-12-11/h2-4,11-12H,5-7H2,1H3
InChIKeyRHBRMMRBLOETOA-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.38
Rot. Bonds1

About 2-(6-methyl-2-pyridinyl)piperidin-4-one

2-(6-methyl-2-pyridinyl)piperidin-4-one (PubChem CID 82403926) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(6-methyl-2-pyridinyl)piperidin-4-one.

Molecular Properties

Compound Name2-(6-methyl-2-pyridinyl)piperidin-4-one
PubChem CID82403926
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-(6-methyl-2-pyridinyl)piperidin-4-one
SMILESCc1cccc(C2CC(=O)CCN2)n1
InChIInChI=1S/C11H14N2O/c1-8-3-2-4-10(13-8)11-7-9(14)5-6-12-11/h2-4,11-12H,5-7H2,1H3
InChIKeyRHBRMMRBLOETOA-UHFFFAOYSA-N
XLogP1.38
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-2-pyridinyl)piperidin-4-one?
The IUPAC name of 2-(6-methyl-2-pyridinyl)piperidin-4-one (CID 82403926) is 2-(6-methyl-2-pyridinyl)piperidin-4-one.
What is the SMILES notation for 2-(6-methyl-2-pyridinyl)piperidin-4-one?
The canonical SMILES for 2-(6-methyl-2-pyridinyl)piperidin-4-one is Cc1cccc(C2CC(=O)CCN2)n1.
What is the InChIKey of 2-(6-methyl-2-pyridinyl)piperidin-4-one?
The InChIKey is RHBRMMRBLOETOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8-3-2-4-10(13-8)11-7-9(14)5-6-12-11/h2-4,11-12H,5-7H2,1H3.
What are the key properties of 2-(6-methyl-2-pyridinyl)piperidin-4-one?
2-(6-methyl-2-pyridinyl)piperidin-4-one has a molecular weight of 190.25 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-2-pyridinyl)piperidin-4-one is sourced from PubChem (CID 82403926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).