4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine

C14H19F2N — CID 130179117

IUPAC4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine
SMILESCC(C)c1cc(F)c(C2CCNCC2)c(F)c1
InChIInChI=1S/C14H19F2N/c1-9(2)11-7-12(15)14(13(16)8-11)10-3-5-17-6-4-10/h7-10,17H,3-6H2,1-2H3
InChIKeyDPMDSQACCHFTHV-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.56
Rot. Bonds2

About 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine

4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine (PubChem CID 130179117) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine.

Molecular Properties

Compound Name4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine
PubChem CID130179117
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine
SMILESCC(C)c1cc(F)c(C2CCNCC2)c(F)c1
InChIInChI=1S/C14H19F2N/c1-9(2)11-7-12(15)14(13(16)8-11)10-3-5-17-6-4-10/h7-10,17H,3-6H2,1-2H3
InChIKeyDPMDSQACCHFTHV-UHFFFAOYSA-N
XLogP3.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine?
The IUPAC name of 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine (CID 130179117) is 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine.
What is the SMILES notation for 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine?
The canonical SMILES for 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine is CC(C)c1cc(F)c(C2CCNCC2)c(F)c1.
What is the InChIKey of 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine?
The InChIKey is DPMDSQACCHFTHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-9(2)11-7-12(15)14(13(16)8-11)10-3-5-17-6-4-10/h7-10,17H,3-6H2,1-2H3.
What are the key properties of 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine?
4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine has a molecular weight of 239.31 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluoro-4-propan-2-ylphenyl)piperidine is sourced from PubChem (CID 130179117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).