1-(3,5-difluorophenyl)piperidine

C11H13F2N — CID 55251038

IUPAC1-(3,5-difluorophenyl)piperidine
SMILESFc1cc(F)cc(N2CCCCC2)c1
InChIInChI=1S/C11H13F2N/c12-9-6-10(13)8-11(7-9)14-4-2-1-3-5-14/h6-8H,1-5H2
InChIKeyRMSGTWFYPRLJNB-UHFFFAOYSA-N
MW197.23 g/mol
LogP2.96
Rot. Bonds1

About 1-(3,5-difluorophenyl)piperidine

1-(3,5-difluorophenyl)piperidine (PubChem CID 55251038) has the molecular formula C11H13F2N and a molecular weight of 197.23 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)piperidine.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)piperidine
PubChem CID55251038
Molecular FormulaC11H13F2N
Molecular Weight197.23 g/mol
Exact Mass197.10
IUPAC Name1-(3,5-difluorophenyl)piperidine
SMILESFc1cc(F)cc(N2CCCCC2)c1
InChIInChI=1S/C11H13F2N/c12-9-6-10(13)8-11(7-9)14-4-2-1-3-5-14/h6-8H,1-5H2
InChIKeyRMSGTWFYPRLJNB-UHFFFAOYSA-N
XLogP2.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,5-difluorophenyl)pyrrolidine
CID 18454792
3-(azocan-1-yl)-5-fluorobenzonitrile
CID 102815222
1-[3-(chloromethyl)-5-fluorophenyl]azocane
CID 106530289
1-(3-fluoro-5-piperidin-1-ylphenyl)ethanone
CID 82535446
(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine
CID 102813283
1-(3,4,5-trifluorophenyl)pyrrolidine
CID 67937065
1-(3-fluoro-5-nitrophenyl)pyrrolidine
CID 22636164
3-fluoro-N-propan-2-yl-5-pyrrolidin-1-ylaniline
CID 115885020
3-fluoro-5-pyrrolidin-1-ylbenzoyl chloride
CID 87841147
4-(3,5-difluorophenyl)piperazine-1-carbaldehyde
CID 134499697
3,5-di(piperidin-1-yl)phenol
CID 16638574
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)piperidine?
The IUPAC name of 1-(3,5-difluorophenyl)piperidine (CID 55251038) is 1-(3,5-difluorophenyl)piperidine.
What is the SMILES notation for 1-(3,5-difluorophenyl)piperidine?
The canonical SMILES for 1-(3,5-difluorophenyl)piperidine is Fc1cc(F)cc(N2CCCCC2)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)piperidine?
The InChIKey is RMSGTWFYPRLJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2N/c12-9-6-10(13)8-11(7-9)14-4-2-1-3-5-14/h6-8H,1-5H2.
What are the key properties of 1-(3,5-difluorophenyl)piperidine?
1-(3,5-difluorophenyl)piperidine has a molecular weight of 197.23 g/mol, XLogP of 2.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)piperidine is sourced from PubChem (CID 55251038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).