4-(azetidin-1-yl)-3,3-difluoropiperidine

C8H14F2N2 — CID 130999129

IUPAC4-(azetidin-1-yl)-3,3-difluoropiperidine
SMILESFC1(F)CNCCC1N1CCC1
InChIInChI=1S/C8H14F2N2/c9-8(10)6-11-3-2-7(8)12-4-1-5-12/h7,11H,1-6H2
InChIKeyYWFWQHVMLDWGLX-UHFFFAOYSA-N
MW176.21 g/mol
LogP0.69
Rot. Bonds1

About 4-(azetidin-1-yl)-3,3-difluoropiperidine

4-(azetidin-1-yl)-3,3-difluoropiperidine (PubChem CID 130999129) has the molecular formula C8H14F2N2 and a molecular weight of 176.21 g/mol. Its IUPAC name is 4-(azetidin-1-yl)-3,3-difluoropiperidine.

Molecular Properties

Compound Name4-(azetidin-1-yl)-3,3-difluoropiperidine
PubChem CID130999129
Molecular FormulaC8H14F2N2
Molecular Weight176.21 g/mol
Exact Mass176.11
IUPAC Name4-(azetidin-1-yl)-3,3-difluoropiperidine
SMILESFC1(F)CNCCC1N1CCC1
InChIInChI=1S/C8H14F2N2/c9-8(10)6-11-3-2-7(8)12-4-1-5-12/h7,11H,1-6H2
InChIKeyYWFWQHVMLDWGLX-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-difluoro-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 129320018
3,3-difluoro-4-pyrrolidin-1-ylpyrrolidine
CID 115014675
(4S)-3,3,4-trifluoroazepane;hydrochloride
CID 171991664
4-[[5-[4-(3,3-difluoropiperidin-4-yl)piperazin-1-yl]-6-fluoro-2-pyridinyl]amino]cyclohexane-1,3-dione
CID 165010805
1-tert-butyl-4-(3,3-dimethylpiperidin-4-yl)piperazine
CID 114235704
2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine
CID 71669027
3,3-difluoro-4-propan-2-ylpiperidine
CID 58394614
(4S)-3,3-difluoro-N,N-dimethylpiperidin-4-amine
CID 125499591
3-(azetidin-1-yl)pyrrolidine;hydrochloride
CID 53414698
6,6-difluoro-1,7-di(propan-2-yl)-1,4-diazepane
CID 175613591
3-[4-[4-[(4S)-3,3-difluoropiperidin-4-yl]piperazin-1-yl]-3-methyl-2-oxoimidazo[4,5-c]pyridin-1-yl]piperidine-2,6-dione
CID 169120350
(4R)-3,3-difluoropiperidine-4-carboxylic acid;hydrochloride
CID 163342247

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-1-yl)-3,3-difluoropiperidine?
The IUPAC name of 4-(azetidin-1-yl)-3,3-difluoropiperidine (CID 130999129) is 4-(azetidin-1-yl)-3,3-difluoropiperidine.
What is the SMILES notation for 4-(azetidin-1-yl)-3,3-difluoropiperidine?
The canonical SMILES for 4-(azetidin-1-yl)-3,3-difluoropiperidine is FC1(F)CNCCC1N1CCC1.
What is the InChIKey of 4-(azetidin-1-yl)-3,3-difluoropiperidine?
The InChIKey is YWFWQHVMLDWGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2N2/c9-8(10)6-11-3-2-7(8)12-4-1-5-12/h7,11H,1-6H2.
What are the key properties of 4-(azetidin-1-yl)-3,3-difluoropiperidine?
4-(azetidin-1-yl)-3,3-difluoropiperidine has a molecular weight of 176.21 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-1-yl)-3,3-difluoropiperidine is sourced from PubChem (CID 130999129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).