2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one

C15H24N2O2 — CID 79884588

IUPAC2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one
SMILESCc1cc(=O)cc(C)n1CCCOC1CCNCC1
InChIInChI=1S/C15H24N2O2/c1-12-10-14(18)11-13(2)17(12)8-3-9-19-15-4-6-16-7-5-15/h10-11,15-16H,3-9H2,1-2H3
InChIKeyYPIFHXALWAKKGE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.62
Rot. Bonds5

About 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one

2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one (PubChem CID 79884588) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one.

Molecular Properties

Compound Name2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one
PubChem CID79884588
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one
SMILESCc1cc(=O)cc(C)n1CCCOC1CCNCC1
InChIInChI=1S/C15H24N2O2/c1-12-10-14(18)11-13(2)17(12)8-3-9-19-15-4-6-16-7-5-15/h10-11,15-16H,3-9H2,1-2H3
InChIKeyYPIFHXALWAKKGE-UHFFFAOYSA-N
XLogP1.62
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

2,6-dimethyl-1H-pyridin-4-one;piperidine
CID 142375468
2,6-dimethyl-1H-pyridin-4-one;(2R)-2-methylpiperidine
CID 156748457
2,6-Dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
CID 79884499
2,6-Dimethyl-1-piperidin-4-ylpyridin-4-one
CID 79885165
2,6-Dimethyl-1-piperidin-3-ylpyridin-4-one
CID 79885789
2-methyl-3-piperidin-4-yloxy-1H-pyridin-4-one
CID 84676150
1,2-Dimethyl-3-piperidin-4-yloxypyridin-4-one
CID 84687731
(E)-4-(2-piperidin-1-ylethylamino)pent-3-en-2-one
CID 102045232
2,6-Dimethyl-1-(morpholin-3-ylmethyl)pyridin-4-one
CID 103549618
3-[(4-Methylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one
CID 104788606
2,6-Dimethyl-1-(2-methylpiperidin-4-yl)pyridin-4-one
CID 106996379
3-[(4-Ethylmorpholin-2-yl)methylamino]cyclopent-2-en-1-one
CID 114400483

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one?
The IUPAC name of 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one (CID 79884588) is 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one.
What is the SMILES notation for 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one?
The canonical SMILES for 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one is Cc1cc(=O)cc(C)n1CCCOC1CCNCC1.
What is the InChIKey of 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one?
The InChIKey is YPIFHXALWAKKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12-10-14(18)11-13(2)17(12)8-3-9-19-15-4-6-16-7-5-15/h10-11,15-16H,3-9H2,1-2H3.
What are the key properties of 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one?
2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one has a molecular weight of 264.37 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-1-(3-piperidin-4-yloxypropyl)pyridin-4-one is sourced from PubChem (CID 79884588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).