2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine

C21H26FNO — CID 175215705

IUPAC2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine
SMILESFCC1(OCc2ccccc2)CCCCN1CCc1ccccc1
InChIInChI=1S/C21H26FNO/c22-18-21(24-17-20-11-5-2-6-12-20)14-7-8-15-23(21)16-13-19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2
InChIKeyJIKCZBSGIGTKJV-UHFFFAOYSA-N
MW327.44 g/mol
LogP4.60
Rot. Bonds7

About 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine

2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine (PubChem CID 175215705) has the molecular formula C21H26FNO and a molecular weight of 327.44 g/mol. Its IUPAC name is 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine.

Molecular Properties

Compound Name2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine
PubChem CID175215705
Molecular FormulaC21H26FNO
Molecular Weight327.44 g/mol
Exact Mass327.20
IUPAC Name2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine
SMILESFCC1(OCc2ccccc2)CCCCN1CCc1ccccc1
InChIInChI=1S/C21H26FNO/c22-18-21(24-17-20-11-5-2-6-12-20)14-7-8-15-23(21)16-13-19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2
InChIKeyJIKCZBSGIGTKJV-UHFFFAOYSA-N
XLogP4.60
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.44
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(bromomethyl)-1-(2-cyclohexylethyl)-2-phenylmethoxypiperidine
CID 175208324
1-[(4,4-difluorocyclohexyl)methyl]-2-methyl-2-phenylmethoxypiperidine
CID 175211247
1-[(4-cyclopropylcyclohexyl)methyl]-2-methyl-2-phenylmethoxypiperidine
CID 175205971
2-phenylmethoxy-2-(phenylmethoxymethyl)-1-(pyrrolidin-3-ylmethyl)piperidine
CID 175407502
1-[[1-(4-fluorophenyl)piperidin-4-yl]methyl]-2-methyl-2-phenylmethoxypiperidine
CID 175216623
2,2-dimethyl-1-(2-phenylethyl)piperidin-3-one
CID 117019112
2-methyl-2-phenylmethoxy-1-[[1-[4-(trifluoromethyl)phenyl]piperidin-4-yl]methyl]piperidine
CID 175211251
2,2-dimethyl-1-(2-phenylethyl)piperidine-3-carboxylic acid
CID 117019433
2-ethyl-1-(2-phenylethyl)pyrrolidine-2-carboxylic acid
CID 83080889
(1-phenylmethoxycyclopentyl)methanamine
CID 62107893
2-methyl-2-phenylmethoxy-1-[(1-thiophen-3-ylpyrrolidin-3-yl)methyl]piperidine
CID 175211306
[1-(iodomethyl)cyclohexyl]oxymethylbenzene
CID 114772517

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine?
The IUPAC name of 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine (CID 175215705) is 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine.
What is the SMILES notation for 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine?
The canonical SMILES for 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine is FCC1(OCc2ccccc2)CCCCN1CCc1ccccc1.
What is the InChIKey of 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine?
The InChIKey is JIKCZBSGIGTKJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26FNO/c22-18-21(24-17-20-11-5-2-6-12-20)14-7-8-15-23(21)16-13-19-9-3-1-4-10-19/h1-6,9-12H,7-8,13-18H2.
What are the key properties of 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine?
2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine has a molecular weight of 327.44 g/mol, XLogP of 4.60, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1-(2-phenylethyl)-2-phenylmethoxypiperidine is sourced from PubChem (CID 175215705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).