2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine

C16H23F2N — CID 106882953

IUPAC2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine
SMILESCc1cc(C)c(C(C)(F)CC2CCCCN2)c(F)c1
InChIInChI=1S/C16H23F2N/c1-11-8-12(2)15(14(17)9-11)16(3,18)10-13-6-4-5-7-19-13/h8-9,13,19H,4-7,10H2,1-3H3
InChIKeyRBBIIYSOMCVBBV-UHFFFAOYSA-N
MW267.36 g/mol
LogP4.16
Rot. Bonds3

About 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine

2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine (PubChem CID 106882953) has the molecular formula C16H23F2N and a molecular weight of 267.36 g/mol. Its IUPAC name is 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine.

Molecular Properties

Compound Name2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine
PubChem CID106882953
Molecular FormulaC16H23F2N
Molecular Weight267.36 g/mol
Exact Mass267.18
IUPAC Name2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine
SMILESCc1cc(C)c(C(C)(F)CC2CCCCN2)c(F)c1
InChIInChI=1S/C16H23F2N/c1-11-8-12(2)15(14(17)9-11)16(3,18)10-13-6-4-5-7-19-13/h8-9,13,19H,4-7,10H2,1-3H3
InChIKeyRBBIIYSOMCVBBV-UHFFFAOYSA-N
XLogP4.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-fluoro-3-(4-fluoro-2-methylphenyl)-2-methylpropyl]piperidine
CID 114350316
2-[3-(3,5-difluorophenyl)-2-fluoro-2-methylpropyl]piperidine
CID 105411766
2-[2-(2,5-dimethylphenyl)-2,2-difluoroethyl]pyrrolidine
CID 116840108
1-(4-fluoro-2-methylphenyl)-2-methyl-3-piperidin-2-ylpropan-2-ol
CID 114347033
2-[2-methyl-4-(trifluoromethyl)phenyl]-1-piperidin-2-ylpropan-2-ol
CID 102751951
2-(2-fluoro-1-pyrrolidin-2-ylpropan-2-yl)-1H-pyrrole
CID 130992693
1-(2-fluoro-4,6-dimethylphenyl)-2-pyrrolidin-2-ylethanone
CID 106883000
2-[(2-chloro-3,5-dimethylphenyl)methyl]piperidine
CID 117348318
2-[2-(2,4-difluorophenyl)-2,2-difluoroethyl]piperidine
CID 116840282
4-fluoro-5-methyl-2-(piperidin-2-ylmethyl)phenol
CID 117320372
2-(3-bromo-2,6-difluorophenyl)-1-piperidin-2-ylpropan-2-ol
CID 106941489
1-cyclopropyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106880260

Frequently Asked Questions

What is the IUPAC name of 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine?
The IUPAC name of 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine (CID 106882953) is 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine.
What is the SMILES notation for 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine?
The canonical SMILES for 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine is Cc1cc(C)c(C(C)(F)CC2CCCCN2)c(F)c1.
What is the InChIKey of 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine?
The InChIKey is RBBIIYSOMCVBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F2N/c1-11-8-12(2)15(14(17)9-11)16(3,18)10-13-6-4-5-7-19-13/h8-9,13,19H,4-7,10H2,1-3H3.
What are the key properties of 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine?
2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine has a molecular weight of 267.36 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoro-2-(2-fluoro-4,6-dimethylphenyl)propyl]piperidine is sourced from PubChem (CID 106882953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).