cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone

C18H24FNO2 — CID 56783974

IUPACcyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC(C(O)c2ccc(F)cc2)CC1
InChIInChI=1S/C18H24FNO2/c19-16-7-5-13(6-8-16)17(21)14-9-11-20(12-10-14)18(22)15-3-1-2-4-15/h5-8,14-15,17,21H,1-4,9-12H2
InChIKeyUVDPIWARKXEEED-UHFFFAOYSA-N
MW305.39 g/mol
LogP3.29
Rot. Bonds3

About cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone

cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone (PubChem CID 56783974) has the molecular formula C18H24FNO2 and a molecular weight of 305.39 g/mol. Its IUPAC name is cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone
PubChem CID56783974
Molecular FormulaC18H24FNO2
Molecular Weight305.39 g/mol
Exact Mass305.18
IUPAC Namecyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC(C(O)c2ccc(F)cc2)CC1
InChIInChI=1S/C18H24FNO2/c19-16-7-5-13(6-8-16)17(21)14-9-11-20(12-10-14)18(22)15-3-1-2-4-15/h5-8,14-15,17,21H,1-4,9-12H2
InChIKeyUVDPIWARKXEEED-UHFFFAOYSA-N
XLogP3.29
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.39
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol
CID 44363475
(4-Fluoro-phenyl)-(1-phenethyl-piperidin-4-yl)-methanol
CID 10245066
(4-Fluoro-phenyl)-[1-(4-phenyl-butyl)-piperidin-4-yl]-methanol
CID 15212884
1-[4-(3-Fluorophenyl)-4-hydroxypiperidin-1-yl]butan-1-one
CID 1446465
Cyclobutyl-[4-(3-fluorophenyl)-4-hydroxypiperidin-1-yl]methanone
CID 1446508
4-(4-Benzylpiperidin-1-yl)-1-(4-fluorophenyl)butan-1-ol
CID 9798088
1-(4-Hydroxy-4,4-diphenylbutyl)piperidin-2-one
CID 118753546
1-(4-Fluorophenyl)-4-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]butan-1-ol
CID 10666185
2-(4-Fluorophenyl)-1-[4-(2-hydroxy-2-phenylethyl)piperazin-1-yl]ethanone
CID 53530310
2-Cyclopentyloxy-1-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]ethanone
CID 56783973
1-[4-[2-(4-Fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]-2-phenylethanone
CID 56812942
2-(2-hydroxyethyl)-9-[(3S)-3-hydroxy-3-phenylpropyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 70718234

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone (CID 56783974) is cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone is O=C(C1CCCC1)N1CCC(C(O)c2ccc(F)cc2)CC1.
What is the InChIKey of cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone?
The InChIKey is UVDPIWARKXEEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FNO2/c19-16-7-5-13(6-8-16)17(21)14-9-11-20(12-10-14)18(22)15-3-1-2-4-15/h5-8,14-15,17,21H,1-4,9-12H2.
What are the key properties of cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone?
cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone has a molecular weight of 305.39 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]methanone is sourced from PubChem (CID 56783974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).