4-(4-chlorophenyl)-3,3-difluoropiperidine

C11H12ClF2N — CID 67962435

IUPAC4-(4-chlorophenyl)-3,3-difluoropiperidine
SMILESFC1(F)CNCCC1c1ccc(Cl)cc1
InChIInChI=1S/C11H12ClF2N/c12-9-3-1-8(2-4-9)10-5-6-15-7-11(10,13)14/h1-4,10,15H,5-7H2
InChIKeyNZRUHIBQAINWQO-UHFFFAOYSA-N
MW231.67 g/mol
LogP3.05
Rot. Bonds1

About 4-(4-chlorophenyl)-3,3-difluoropiperidine

4-(4-chlorophenyl)-3,3-difluoropiperidine (PubChem CID 67962435) has the molecular formula C11H12ClF2N and a molecular weight of 231.67 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-3,3-difluoropiperidine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-3,3-difluoropiperidine
PubChem CID67962435
Molecular FormulaC11H12ClF2N
Molecular Weight231.67 g/mol
Exact Mass231.06
IUPAC Name4-(4-chlorophenyl)-3,3-difluoropiperidine
SMILESFC1(F)CNCCC1c1ccc(Cl)cc1
InChIInChI=1S/C11H12ClF2N/c12-9-3-1-8(2-4-9)10-5-6-15-7-11(10,13)14/h1-4,10,15H,5-7H2
InChIKeyNZRUHIBQAINWQO-UHFFFAOYSA-N
XLogP3.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.67
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(4-chlorophenyl)-3,3-difluoropiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4R)-3,3-difluoro-4-phenylpiperidine
CID 97032408
4-(4-chlorophenyl)piperidine;ethane
CID 143751340
4-(3-bromophenyl)-3,3-difluoropiperidine
CID 105426890
3-(3,3-difluoropiperidin-4-yl)phenol
CID 105426893
3,4-bis(4-chlorophenyl)piperidine
CID 79434307
(3S)-3-(4-chlorophenyl)pyrrolidine;hydrochloride
CID 71742220
5-(4-chlorophenyl)-3-azaspiro[5.5]undecane
CID 79434527
4-[(3-chlorophenyl)methyl]-3,3-difluoropiperidine
CID 84705382
1-(4-chlorophenyl)-2,7-diazaspiro[4.4]nonane
CID 172865059
4-(4-fluorophenyl)-3,3-dimethylpiperidine;pentakis(yttrium)
CID 159623116
4-[(2-chlorophenyl)methyl]-3,3-difluoropiperidine
CID 84705381
(3R,4R)-3-(4-chlorophenyl)-4-methylpiperidine
CID 70225291

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-3,3-difluoropiperidine?
The IUPAC name of 4-(4-chlorophenyl)-3,3-difluoropiperidine (CID 67962435) is 4-(4-chlorophenyl)-3,3-difluoropiperidine.
What is the SMILES notation for 4-(4-chlorophenyl)-3,3-difluoropiperidine?
The canonical SMILES for 4-(4-chlorophenyl)-3,3-difluoropiperidine is FC1(F)CNCCC1c1ccc(Cl)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-3,3-difluoropiperidine?
The InChIKey is NZRUHIBQAINWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClF2N/c12-9-3-1-8(2-4-9)10-5-6-15-7-11(10,13)14/h1-4,10,15H,5-7H2.
What are the key properties of 4-(4-chlorophenyl)-3,3-difluoropiperidine?
4-(4-chlorophenyl)-3,3-difluoropiperidine has a molecular weight of 231.67 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-3,3-difluoropiperidine is sourced from PubChem (CID 67962435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).