1-cyclobutyl-4,4-difluoropiperidine

C9H15F2N — CID 91599149

IUPAC1-cyclobutyl-4,4-difluoropiperidine
SMILESFC1(F)CCN(C2CCC2)CC1
InChIInChI=1S/C9H15F2N/c10-9(11)4-6-12(7-5-9)8-2-1-3-8/h8H,1-7H2
InChIKeyVXPFJNHXARQEFY-UHFFFAOYSA-N
MW175.22 g/mol
LogP2.27
Rot. Bonds1

About 1-cyclobutyl-4,4-difluoropiperidine

1-cyclobutyl-4,4-difluoropiperidine (PubChem CID 91599149) has the molecular formula C9H15F2N and a molecular weight of 175.22 g/mol. Its IUPAC name is 1-cyclobutyl-4,4-difluoropiperidine.

Molecular Properties

Compound Name1-cyclobutyl-4,4-difluoropiperidine
PubChem CID91599149
Molecular FormulaC9H15F2N
Molecular Weight175.22 g/mol
Exact Mass175.12
IUPAC Name1-cyclobutyl-4,4-difluoropiperidine
SMILESFC1(F)CCN(C2CCC2)CC1
InChIInChI=1S/C9H15F2N/c10-9(11)4-6-12(7-5-9)8-2-1-3-8/h8H,1-7H2
InChIKeyVXPFJNHXARQEFY-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.22
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4,4-difluoropiperidine?
The IUPAC name of 1-cyclobutyl-4,4-difluoropiperidine (CID 91599149) is 1-cyclobutyl-4,4-difluoropiperidine.
What is the SMILES notation for 1-cyclobutyl-4,4-difluoropiperidine?
The canonical SMILES for 1-cyclobutyl-4,4-difluoropiperidine is FC1(F)CCN(C2CCC2)CC1.
What is the InChIKey of 1-cyclobutyl-4,4-difluoropiperidine?
The InChIKey is VXPFJNHXARQEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2N/c10-9(11)4-6-12(7-5-9)8-2-1-3-8/h8H,1-7H2.
What are the key properties of 1-cyclobutyl-4,4-difluoropiperidine?
1-cyclobutyl-4,4-difluoropiperidine has a molecular weight of 175.22 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4,4-difluoropiperidine is sourced from PubChem (CID 91599149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).