1-cyclobutyl-3-fluoro-4-methylpiperidine

C10H18FN — CID 130674980

IUPAC1-cyclobutyl-3-fluoro-4-methylpiperidine
SMILESCC1CCN(C2CCC2)CC1F
InChIInChI=1S/C10H18FN/c1-8-5-6-12(7-10(8)11)9-3-2-4-9/h8-10H,2-7H2,1H3
InChIKeyJWUXLLRFGYNOMC-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.22
Rot. Bonds1

About 1-cyclobutyl-3-fluoro-4-methylpiperidine

1-cyclobutyl-3-fluoro-4-methylpiperidine (PubChem CID 130674980) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 1-cyclobutyl-3-fluoro-4-methylpiperidine.

Molecular Properties

Compound Name1-cyclobutyl-3-fluoro-4-methylpiperidine
PubChem CID130674980
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name1-cyclobutyl-3-fluoro-4-methylpiperidine
SMILESCC1CCN(C2CCC2)CC1F
InChIInChI=1S/C10H18FN/c1-8-5-6-12(7-10(8)11)9-3-2-4-9/h8-10H,2-7H2,1H3
InChIKeyJWUXLLRFGYNOMC-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3S,4S)-1-cyclopentyl-4-methyl-3-propan-2-ylpiperidine
CID 134195528
(3S,4R)-1-cyclopentyl-3,4-difluoropyrrolidine
CID 67175459
1-cyclohexyl-3-methylpyrrolidine
CID 13402657
4-bromo-1-cyclopentyl-3-methylpiperidine
CID 114682512
1-cyclohexyl-3,4-difluoropyrrolidine
CID 53420720
(3S)-1-cyclopentylpyrrolidin-3-ol
CID 58155463
(3S)-1-cyclobutyl-3-methyl-4-propan-2-ylpiperidine
CID 134195627
bis(1-cyclopentylpyrrolidin-3-amine);dihydrochloride
CID 173089103
(3R)-1-cyclopentylpyrrolidin-3-amine;hydrochloride
CID 90422333
4-cyclobutyl-2-methyl-1,4-thiazinane 1-oxide
CID 130891121
1-cyclohexyl-4-(4-methylpiperidin-1-yl)piperidine
CID 1121684
2-cyclobutyl-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 79926329

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-fluoro-4-methylpiperidine?
The IUPAC name of 1-cyclobutyl-3-fluoro-4-methylpiperidine (CID 130674980) is 1-cyclobutyl-3-fluoro-4-methylpiperidine.
What is the SMILES notation for 1-cyclobutyl-3-fluoro-4-methylpiperidine?
The canonical SMILES for 1-cyclobutyl-3-fluoro-4-methylpiperidine is CC1CCN(C2CCC2)CC1F.
What is the InChIKey of 1-cyclobutyl-3-fluoro-4-methylpiperidine?
The InChIKey is JWUXLLRFGYNOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN/c1-8-5-6-12(7-10(8)11)9-3-2-4-9/h8-10H,2-7H2,1H3.
What are the key properties of 1-cyclobutyl-3-fluoro-4-methylpiperidine?
1-cyclobutyl-3-fluoro-4-methylpiperidine has a molecular weight of 171.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-fluoro-4-methylpiperidine is sourced from PubChem (CID 130674980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).