3-cyclohexyl-4-fluoro-4-methylpiperidine

C12H22FN — CID 84721139

IUPAC3-cyclohexyl-4-fluoro-4-methylpiperidine
SMILESCC1(F)CCNCC1C1CCCCC1
InChIInChI=1S/C12H22FN/c1-12(13)7-8-14-9-11(12)10-5-3-2-4-6-10/h10-11,14H,2-9H2,1H3
InChIKeyBIDLRJJDFRKYBA-UHFFFAOYSA-N
MW199.31 g/mol
LogP2.90
Rot. Bonds1

About 3-cyclohexyl-4-fluoro-4-methylpiperidine

3-cyclohexyl-4-fluoro-4-methylpiperidine (PubChem CID 84721139) has the molecular formula C12H22FN and a molecular weight of 199.31 g/mol. Its IUPAC name is 3-cyclohexyl-4-fluoro-4-methylpiperidine.

Molecular Properties

Compound Name3-cyclohexyl-4-fluoro-4-methylpiperidine
PubChem CID84721139
Molecular FormulaC12H22FN
Molecular Weight199.31 g/mol
Exact Mass199.17
IUPAC Name3-cyclohexyl-4-fluoro-4-methylpiperidine
SMILESCC1(F)CCNCC1C1CCCCC1
InChIInChI=1S/C12H22FN/c1-12(13)7-8-14-9-11(12)10-5-3-2-4-6-10/h10-11,14H,2-9H2,1H3
InChIKeyBIDLRJJDFRKYBA-UHFFFAOYSA-N
XLogP2.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.31
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cycloheptyl-4-fluoro-4-methylpiperidine
CID 84723549
3-cyclobutyl-4-fluoro-4-methylpiperidine
CID 84717415
4-cyclopentyl-3-fluoro-3-methylpyrrolidine
CID 115013913
5-cyclopentyl-3-azaspiro[5.6]dodecane
CID 112570787
3-cyclopentyl-4-methyl-4-propan-2-ylpiperidine
CID 112570765
4-cyclopropyl-3-fluoro-3-methylpyrrolidine
CID 115011539
2-cyclohexyl-3-fluoro-3-methylpyrrolidine
CID 84718947
(3S,4S)-3,4-difluoro-4-methylpiperidine
CID 125117149
5-cyclopentyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 112570873
9-tert-butyl-5-cyclopentyl-3-azaspiro[5.5]undecane
CID 115927129
11-cyclopentyl-3-oxa-9-azaspiro[5.5]undecane
CID 112570802
3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine
CID 112570898

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-4-fluoro-4-methylpiperidine?
The IUPAC name of 3-cyclohexyl-4-fluoro-4-methylpiperidine (CID 84721139) is 3-cyclohexyl-4-fluoro-4-methylpiperidine.
What is the SMILES notation for 3-cyclohexyl-4-fluoro-4-methylpiperidine?
The canonical SMILES for 3-cyclohexyl-4-fluoro-4-methylpiperidine is CC1(F)CCNCC1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-4-fluoro-4-methylpiperidine?
The InChIKey is BIDLRJJDFRKYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22FN/c1-12(13)7-8-14-9-11(12)10-5-3-2-4-6-10/h10-11,14H,2-9H2,1H3.
What are the key properties of 3-cyclohexyl-4-fluoro-4-methylpiperidine?
3-cyclohexyl-4-fluoro-4-methylpiperidine has a molecular weight of 199.31 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-4-fluoro-4-methylpiperidine is sourced from PubChem (CID 84721139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).