4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one

C15H20FNO2 — CID 82486693

IUPAC4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one
SMILESO=C(CCCc1ccc(F)cc1)N1CCC(O)CC1
InChIInChI=1S/C15H20FNO2/c16-13-6-4-12(5-7-13)2-1-3-15(19)17-10-8-14(18)9-11-17/h4-7,14,18H,1-3,8-11H2
InChIKeyZIXZBDYJAQMEEP-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.13
Rot. Bonds4

About 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one

4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one (PubChem CID 82486693) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one
PubChem CID82486693
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one
SMILESO=C(CCCc1ccc(F)cc1)N1CCC(O)CC1
InChIInChI=1S/C15H20FNO2/c16-13-6-4-12(5-7-13)2-1-3-15(19)17-10-8-14(18)9-11-17/h4-7,14,18H,1-3,8-11H2
InChIKeyZIXZBDYJAQMEEP-UHFFFAOYSA-N
XLogP2.13
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-hydroxypiperidin-1-yl)-4-[4-(2-methylpropyl)phenyl]butan-1-one
CID 109378494
1-(4-acetyl-6-hydroxy-1,4-diazepan-1-yl)-4-(4-fluorophenyl)butan-1-one
CID 118791784
4-(3,4-dichlorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one
CID 110897013
1-(1,4-diazepan-1-yl)-4-(4-fluorophenyl)butan-1-one
CID 82091540
4-fluoro-N-[4-(4-hydroxypiperidin-1-yl)-4-oxobutyl]benzamide
CID 110903684
5-(4-chlorophenyl)-1-[4-(4-fluorophenyl)piperidin-1-yl]pentan-1-one
CID 57153662
4-(4-fluorophenyl)-1-[(5R)-5-hydroxy-1-oxa-9-azaspiro[5.5]undecan-9-yl]butan-1-one
CID 97150225
4-(4-fluorophenyl)-1-[4-[(1R)-1-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]butan-1-one
CID 96579977
4-(4-fluorophenyl)-1-(5-hydroxy-1-oxa-9-azaspiro[5.5]undecan-9-yl)butan-1-one
CID 72926830
1-(4-hydroxypiperidin-1-yl)-3-[4-(trifluoromethyl)phenyl]propan-1-one
CID 111108326
1-[3-(4-fluorophenyl)propyl]piperidin-4-ol
CID 21180751
1-[4-(2,2-dimethylpropyl)piperazin-1-yl]-4-(4-fluorophenyl)butan-1-one
CID 110308630

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one?
The IUPAC name of 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one (CID 82486693) is 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one.
What is the SMILES notation for 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one?
The canonical SMILES for 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one is O=C(CCCc1ccc(F)cc1)N1CCC(O)CC1.
What is the InChIKey of 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one?
The InChIKey is ZIXZBDYJAQMEEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c16-13-6-4-12(5-7-13)2-1-3-15(19)17-10-8-14(18)9-11-17/h4-7,14,18H,1-3,8-11H2.
What are the key properties of 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one?
4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one has a molecular weight of 265.33 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)butan-1-one is sourced from PubChem (CID 82486693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).