2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol

C23H30FNO — CID 10089567

IUPAC2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol
SMILESOC(Cc1ccc(F)cc1)C1CCN(CCCCc2ccccc2)CC1
InChIInChI=1S/C23H30FNO/c24-22-11-9-20(10-12-22)18-23(26)21-13-16-25(17-14-21)15-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,9-12,21,23,26H,4-5,8,13-18H2
InChIKeyFIFLUTNSIVHHPL-UHFFFAOYSA-N
MW355.50 g/mol
LogP4.46
Rot. Bonds8

About 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol

2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol (PubChem CID 10089567) has the molecular formula C23H30FNO and a molecular weight of 355.50 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol
PubChem CID10089567
Molecular FormulaC23H30FNO
Molecular Weight355.50 g/mol
Exact Mass355.23
IUPAC Name2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol
SMILESOC(Cc1ccc(F)cc1)C1CCN(CCCCc2ccccc2)CC1
InChIInChI=1S/C23H30FNO/c24-22-11-9-20(10-12-22)18-23(26)21-13-16-25(17-14-21)15-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,9-12,21,23,26H,4-5,8,13-18H2
InChIKeyFIFLUTNSIVHHPL-UHFFFAOYSA-N
XLogP4.46
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.50
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Diphenidol
CID 3055
(-)-Vesamicol
CID 659840
Glemanserin
CID 71781
Alphamethadol
CID 62709
3-Heptanol, 6-(dimethylamino)-4,4-diphenyl-
CID 28397
Vesamicol
CID 5662
Betamethadol
CID 10064061
(-)-trans-4-(4'-Fluorophenyl)-3-hydroxymethyl-N-methylpiperidine
CID 2734218
Vesamicol hydrochloride
CID 212231
(1S,2S)-2-(4-Phenyl-1-piperidinyl)cyclohexanol
CID 833992
Alphamethadol hydrochloride, (-)-
CID 3041255
Lobelanidine
CID 442646

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol?
The IUPAC name of 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol (CID 10089567) is 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol.
What is the SMILES notation for 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol?
The canonical SMILES for 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol is OC(Cc1ccc(F)cc1)C1CCN(CCCCc2ccccc2)CC1.
What is the InChIKey of 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol?
The InChIKey is FIFLUTNSIVHHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30FNO/c24-22-11-9-20(10-12-22)18-23(26)21-13-16-25(17-14-21)15-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,9-12,21,23,26H,4-5,8,13-18H2.
What are the key properties of 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol?
2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol has a molecular weight of 355.50 g/mol, XLogP of 4.46, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-[1-(4-phenylbutyl)piperidin-4-yl]ethanol is sourced from PubChem (CID 10089567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).