3-ethyl-4-fluoro-4-methylpiperidine

C8H16FN — CID 84716301

IUPAC3-ethyl-4-fluoro-4-methylpiperidine
SMILESCCC1CNCCC1(C)F
InChIInChI=1S/C8H16FN/c1-3-7-6-10-5-4-8(7,2)9/h7,10H,3-6H2,1-2H3
InChIKeyHACJSMDFVRATGM-UHFFFAOYSA-N
MW145.22 g/mol
LogP1.73
Rot. Bonds1

About 3-ethyl-4-fluoro-4-methylpiperidine

3-ethyl-4-fluoro-4-methylpiperidine (PubChem CID 84716301) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 3-ethyl-4-fluoro-4-methylpiperidine.

Molecular Properties

Compound Name3-ethyl-4-fluoro-4-methylpiperidine
PubChem CID84716301
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name3-ethyl-4-fluoro-4-methylpiperidine
SMILESCCC1CNCCC1(C)F
InChIInChI=1S/C8H16FN/c1-3-7-6-10-5-4-8(7,2)9/h7,10H,3-6H2,1-2H3
InChIKeyHACJSMDFVRATGM-UHFFFAOYSA-N
XLogP1.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-4-methyl-3-propylpiperidine
CID 84716694
3-ethyl-4-methyl-4-propylpiperidine
CID 79321517
(3S,4S)-3,4-difluoro-4-methylpiperidine
CID 125117149
5-ethyl-3-azaspiro[5.11]heptadecane
CID 79321032
5-ethyl-3-azaspiro[5.7]tridecane
CID 79321134
3-ethyl-4-methyl-4-pentylpiperidine
CID 80560272
ethane;4-ethyl-3,3-difluoropyrrolidine
CID 177028431
6-ethyl-2,2,4-trimethyl-8-azaspiro[4.5]decane
CID 106664485
3-cyclobutyl-4-fluoro-4-methylpiperidine
CID 84717415
6-ethyl-2-methyl-1-thia-4,8-diazaspiro[4.5]decane
CID 114510574
3-cyclohexyl-4-fluoro-4-methylpiperidine
CID 84721139
3-cycloheptyl-4-fluoro-4-methylpiperidine
CID 84723549

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-fluoro-4-methylpiperidine?
The IUPAC name of 3-ethyl-4-fluoro-4-methylpiperidine (CID 84716301) is 3-ethyl-4-fluoro-4-methylpiperidine.
What is the SMILES notation for 3-ethyl-4-fluoro-4-methylpiperidine?
The canonical SMILES for 3-ethyl-4-fluoro-4-methylpiperidine is CCC1CNCCC1(C)F.
What is the InChIKey of 3-ethyl-4-fluoro-4-methylpiperidine?
The InChIKey is HACJSMDFVRATGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-3-7-6-10-5-4-8(7,2)9/h7,10H,3-6H2,1-2H3.
What are the key properties of 3-ethyl-4-fluoro-4-methylpiperidine?
3-ethyl-4-fluoro-4-methylpiperidine has a molecular weight of 145.22 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-fluoro-4-methylpiperidine is sourced from PubChem (CID 84716301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).