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

C14H22N2O2 — CID 79884499

IUPAC2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
SMILESCc1cc(=O)cc(C)n1CCOC1CCNCC1
InChIInChI=1S/C14H22N2O2/c1-11-9-13(17)10-12(2)16(11)7-8-18-14-3-5-15-6-4-14/h9-10,14-15H,3-8H2,1-2H3
InChIKeyIRSOWPHPMLFAGK-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.23
Rot. Bonds4

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

2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one (PubChem CID 79884499) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one.

Molecular Properties

Compound Name2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
PubChem CID79884499
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
SMILESCc1cc(=O)cc(C)n1CCOC1CCNCC1
InChIInChI=1S/C14H22N2O2/c1-11-9-13(17)10-12(2)16(11)7-8-18-14-3-5-15-6-4-14/h9-10,14-15H,3-8H2,1-2H3
InChIKeyIRSOWPHPMLFAGK-UHFFFAOYSA-N
XLogP1.23
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one?
The IUPAC name of 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one (CID 79884499) is 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one.
What is the SMILES notation for 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one?
The canonical SMILES for 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one is Cc1cc(=O)cc(C)n1CCOC1CCNCC1.
What is the InChIKey of 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one?
The InChIKey is IRSOWPHPMLFAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-9-13(17)10-12(2)16(11)7-8-18-14-3-5-15-6-4-14/h9-10,14-15H,3-8H2,1-2H3.
What are the key properties of 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one?
2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one has a molecular weight of 250.34 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one is sourced from PubChem (CID 79884499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).