4-(2,4-difluorophenyl)-3-methylpiperidine

C12H15F2N — CID 66279713

IUPAC4-(2,4-difluorophenyl)-3-methylpiperidine
SMILESCC1CNCCC1c1ccc(F)cc1F
InChIInChI=1S/C12H15F2N/c1-8-7-15-5-4-10(8)11-3-2-9(13)6-12(11)14/h2-3,6,8,10,15H,4-5,7H2,1H3
InChIKeyMVXORMIJABZHPV-UHFFFAOYSA-N
MW211.25 g/mol
LogP2.68
Rot. Bonds1

About 4-(2,4-difluorophenyl)-3-methylpiperidine

4-(2,4-difluorophenyl)-3-methylpiperidine (PubChem CID 66279713) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is 4-(2,4-difluorophenyl)-3-methylpiperidine.

Molecular Properties

Compound Name4-(2,4-difluorophenyl)-3-methylpiperidine
PubChem CID66279713
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name4-(2,4-difluorophenyl)-3-methylpiperidine
SMILESCC1CNCCC1c1ccc(F)cc1F
InChIInChI=1S/C12H15F2N/c1-8-7-15-5-4-10(8)11-3-2-9(13)6-12(11)14/h2-3,6,8,10,15H,4-5,7H2,1H3
InChIKeyMVXORMIJABZHPV-UHFFFAOYSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-fluoro-2-methylphenyl)-3-methylpiperidine
CID 66277962
(3R,4R)-4-[4-fluoro-2-(trifluoromethyl)phenyl]-3-methylpiperidine
CID 69231558
(3R,4R)-4-[2-fluoro-4-(trifluoromethyl)phenyl]-3-methylpiperidine
CID 51353699
3-(2,4-difluorophenyl)-2-methylpyrrolidine
CID 62354967
4-(2,3-difluoro-4-methylphenyl)-3-methylpiperidine
CID 107514264
2-(2,4-difluorophenyl)-N-(3-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120555147
4-(4-chloro-2-methylphenyl)-3-methylpiperidine
CID 69230633
3-(3-chlorophenyl)-4-(2,4-difluorophenyl)piperidine
CID 79434014
(3S,4S)-4-[2-(2,4-difluorophenyl)pyrazol-3-yl]-3-methylpiperidine
CID 118166923
4-(4-chloro-2-methylphenyl)-3-methylpiperidine;hydrochloride
CID 69230632
4-(2,5-difluorophenyl)-3-ethylpiperidine
CID 79320741
(3S,4S)-4-[2-chloro-4-(trifluoromethyl)phenyl]-3-methylpiperidine
CID 69230877

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluorophenyl)-3-methylpiperidine?
The IUPAC name of 4-(2,4-difluorophenyl)-3-methylpiperidine (CID 66279713) is 4-(2,4-difluorophenyl)-3-methylpiperidine.
What is the SMILES notation for 4-(2,4-difluorophenyl)-3-methylpiperidine?
The canonical SMILES for 4-(2,4-difluorophenyl)-3-methylpiperidine is CC1CNCCC1c1ccc(F)cc1F.
What is the InChIKey of 4-(2,4-difluorophenyl)-3-methylpiperidine?
The InChIKey is MVXORMIJABZHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2N/c1-8-7-15-5-4-10(8)11-3-2-9(13)6-12(11)14/h2-3,6,8,10,15H,4-5,7H2,1H3.
What are the key properties of 4-(2,4-difluorophenyl)-3-methylpiperidine?
4-(2,4-difluorophenyl)-3-methylpiperidine has a molecular weight of 211.25 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluorophenyl)-3-methylpiperidine is sourced from PubChem (CID 66279713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).