5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one

C15H23FN2O — CID 157413868

IUPAC5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one
SMILESCC(C)Cc1cc(F)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C15H23FN2O/c1-11(2)8-12-9-13(16)10-18(15(12)19)14-4-6-17(3)7-5-14/h9-11,14H,4-8H2,1-3H3
InChIKeyMITNYRLJLOKZID-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.45
Rot. Bonds3

About 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one

5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one (PubChem CID 157413868) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one.

Molecular Properties

Compound Name5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one
PubChem CID157413868
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one
SMILESCC(C)Cc1cc(F)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C15H23FN2O/c1-11(2)8-12-9-13(16)10-18(15(12)19)14-4-6-17(3)7-5-14/h9-11,14H,4-8H2,1-3H3
InChIKeyMITNYRLJLOKZID-UHFFFAOYSA-N
XLogP2.45
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Ethyl-1-[1-(4-fluorocyclohexa-1,5-dien-1-yl)ethyl]piperidin-2-one
CID 89546591
5-Fluoro-1,3-di(propan-2-yl)pyridin-2-one
CID 89728117
5-[2-(5-Fluoro-2-oxo-3-propan-2-yl-1-pyridinyl)propyl]-1,3-di(propan-2-yl)pyridin-2-one
CID 130388598
1-Cyclopropyl-7-fluoro-3,9-dimethyl-8-piperidin-1-ylquinolizin-4-one
CID 142129500
5-[2-(Dimethylamino)ethyl]-3-fluoro-1-(4-methylpentan-2-yl)pyridin-2-one
CID 156283789
3-Tert-butyl-1-[1-(2-fluoroethyl)piperidin-4-yl]pyridin-2-one
CID 156357512
3-Tert-butyl-1-(3-fluoro-1-methylpiperidin-4-yl)pyridin-2-one
CID 156357514
3-Tert-butyl-1-(3,3-difluoro-1-methylpiperidin-4-yl)pyridin-2-one
CID 156357515
3-Ethyl-1-[1-(2-fluoroethyl)piperidin-4-yl]pyridin-2-one
CID 156737838
3-Tert-butyl-5-cyclopropyl-1-[3-(3,3-difluoropiperidin-1-yl)propyl]pyridin-2-one
CID 164559343
1-[3-(3,3-Difluoropiperidin-1-yl)propyl]-3-propan-2-yl-5-(trifluoromethyl)pyridin-2-one;ethane
CID 164559867
(6-Fluoro-2-methylcyclohexa-1,5-dien-1-yl)-(3-methylpiperidin-1-yl)methanone
CID 167114427

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one?
The IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one (CID 157413868) is 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one.
What is the SMILES notation for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one?
The canonical SMILES for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one is CC(C)Cc1cc(F)cn(C2CCN(C)CC2)c1=O.
What is the InChIKey of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one?
The InChIKey is MITNYRLJLOKZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-11(2)8-12-9-13(16)10-18(15(12)19)14-4-6-17(3)7-5-14/h9-11,14H,4-8H2,1-3H3.
What are the key properties of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one?
5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one has a molecular weight of 266.36 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)pyridin-2-one is sourced from PubChem (CID 157413868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).