1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine

C14H18F3N — CID 70124782

IUPAC1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine
SMILESFc1ccc(C(F)(F)CCN2CCCCC2)cc1
InChIInChI=1S/C14H18F3N/c15-13-6-4-12(5-7-13)14(16,17)8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-11H2
InChIKeyKFPJQEDNRVUKIG-UHFFFAOYSA-N
MW257.30 g/mol
LogP3.79
Rot. Bonds4

About 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine

1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine (PubChem CID 70124782) has the molecular formula C14H18F3N and a molecular weight of 257.30 g/mol. Its IUPAC name is 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine.

Molecular Properties

Compound Name1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine
PubChem CID70124782
Molecular FormulaC14H18F3N
Molecular Weight257.30 g/mol
Exact Mass257.14
IUPAC Name1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine
SMILESFc1ccc(C(F)(F)CCN2CCCCC2)cc1
InChIInChI=1S/C14H18F3N/c15-13-6-4-12(5-7-13)14(16,17)8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-11H2
InChIKeyKFPJQEDNRVUKIG-UHFFFAOYSA-N
XLogP3.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-difluoro-2-phenylethyl)piperidine
CID 70652192
bis(4-fluorophenyl)-hydroxy-(3-piperidin-1-ylpropyl)silane
CID 10498821
2-(4-fluorophenyl)-3-methyl-1-piperidin-1-ylbutan-2-amine
CID 43830466
1-(azepan-1-yl)-2-(4-fluorophenyl)-3-methylbutan-2-amine
CID 43830467
1-[2,2-difluoro-2-(4-fluorophenyl)ethyl]piperidin-4-amine
CID 118938536
N-(2-piperidin-1-ylethyl)-4-(trifluoromethyl)aniline
CID 62646483
1-[2-[1-(4-bromophenyl)-1-(4-fluorophenyl)ethoxy]ethyl]pyrrolidine
CID 3024528
1-[2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]ethyl]azepane
CID 110826346
1-[(4-fluorophenyl)methyl]pyrrolidine
CID 10631195
(E)-1-(4-fluorophenyl)-5-piperidin-1-ylpent-1-en-3-one
CID 59444030
1-[3-chloro-4,4-bis(4-fluorophenyl)but-3-enyl]piperidine
CID 110168451
2,2-difluoro-4-piperidin-1-ylbutan-1-amine
CID 69130450

Frequently Asked Questions

What is the IUPAC name of 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine?
The IUPAC name of 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine (CID 70124782) is 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine.
What is the SMILES notation for 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine?
The canonical SMILES for 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine is Fc1ccc(C(F)(F)CCN2CCCCC2)cc1.
What is the InChIKey of 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine?
The InChIKey is KFPJQEDNRVUKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3N/c15-13-6-4-12(5-7-13)14(16,17)8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-11H2.
What are the key properties of 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine?
1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine has a molecular weight of 257.30 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,3-difluoro-3-(4-fluorophenyl)propyl]piperidine is sourced from PubChem (CID 70124782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).