4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine

C15H21F2NO — CID 135323179

IUPAC4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine
SMILESFC(F)OCC1(CCc2ccccc2)CCNCC1
InChIInChI=1S/C15H21F2NO/c16-14(17)19-12-15(8-10-18-11-9-15)7-6-13-4-2-1-3-5-13/h1-5,14,18H,6-12H2
InChIKeyXOBWAVGXFVTFHA-UHFFFAOYSA-N
MW269.33 g/mol
LogP3.23
Rot. Bonds6

About 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine

4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine (PubChem CID 135323179) has the molecular formula C15H21F2NO and a molecular weight of 269.33 g/mol. Its IUPAC name is 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine.

Molecular Properties

Compound Name4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine
PubChem CID135323179
Molecular FormulaC15H21F2NO
Molecular Weight269.33 g/mol
Exact Mass269.16
IUPAC Name4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine
SMILESFC(F)OCC1(CCc2ccccc2)CCNCC1
InChIInChI=1S/C15H21F2NO/c16-14(17)19-12-15(8-10-18-11-9-15)7-6-13-4-2-1-3-5-13/h1-5,14,18H,6-12H2
InChIKeyXOBWAVGXFVTFHA-UHFFFAOYSA-N
XLogP3.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine?
The IUPAC name of 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine (CID 135323179) is 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine.
What is the SMILES notation for 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine?
The canonical SMILES for 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine is FC(F)OCC1(CCc2ccccc2)CCNCC1.
What is the InChIKey of 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine?
The InChIKey is XOBWAVGXFVTFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F2NO/c16-14(17)19-12-15(8-10-18-11-9-15)7-6-13-4-2-1-3-5-13/h1-5,14,18H,6-12H2.
What are the key properties of 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine?
4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine has a molecular weight of 269.33 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxymethyl)-4-(2-phenylethyl)piperidine is sourced from PubChem (CID 135323179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).