1-(4-fluorophenyl)-2-piperidin-2-ylethanol

C13H18FNO — CID 79559666

IUPAC1-(4-fluorophenyl)-2-piperidin-2-ylethanol
SMILESOC(CC1CCCCN1)c1ccc(F)cc1
InChIInChI=1S/C13H18FNO/c14-11-6-4-10(5-7-11)13(16)9-12-3-1-2-8-15-12/h4-7,12-13,15-16H,1-3,8-9H2
InChIKeyUKYZTHLYAZFQGN-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.39
Rot. Bonds3

About 1-(4-fluorophenyl)-2-piperidin-2-ylethanol

1-(4-fluorophenyl)-2-piperidin-2-ylethanol (PubChem CID 79559666) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-piperidin-2-ylethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-piperidin-2-ylethanol
PubChem CID79559666
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name1-(4-fluorophenyl)-2-piperidin-2-ylethanol
SMILESOC(CC1CCCCN1)c1ccc(F)cc1
InChIInChI=1S/C13H18FNO/c14-11-6-4-10(5-7-11)13(16)9-12-3-1-2-8-15-12/h4-7,12-13,15-16H,1-3,8-9H2
InChIKeyUKYZTHLYAZFQGN-UHFFFAOYSA-N
XLogP2.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-phenyl-2-[(2S)-piperidin-2-yl]ethanol
CID 10856632
2-(azocan-2-yl)-1-(4-chlorophenyl)ethanol
CID 114239649
(1S)-2-[(2R)-azepan-2-yl]-1-phenylethanol
CID 95788131
(1R)-2-[(2R)-azepan-2-yl]-1-phenylethanol
CID 95788130
2-(azepan-2-yl)-1-(3-fluorophenyl)ethanol
CID 79560091
1-(4-aminophenyl)-2-pyrrolidin-2-ylethanol
CID 84674533
1-(4-ethylphenyl)-2-pyrrolidin-2-ylethanol
CID 79559738
1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine
CID 116935942
1-(2,4-difluorophenyl)-2-pyrrolidin-2-ylethanol
CID 81466022
1-(3-chlorophenyl)-2-piperidin-2-ylethanol
CID 79559914
N-[(1S)-1-(4-fluorophenyl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 81348101
2-[bis(4-fluorophenyl)methoxymethyl]piperidine
CID 171986478

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-piperidin-2-ylethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-piperidin-2-ylethanol (CID 79559666) is 1-(4-fluorophenyl)-2-piperidin-2-ylethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-piperidin-2-ylethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-piperidin-2-ylethanol is OC(CC1CCCCN1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-piperidin-2-ylethanol?
The InChIKey is UKYZTHLYAZFQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c14-11-6-4-10(5-7-11)13(16)9-12-3-1-2-8-15-12/h4-7,12-13,15-16H,1-3,8-9H2.
What are the key properties of 1-(4-fluorophenyl)-2-piperidin-2-ylethanol?
1-(4-fluorophenyl)-2-piperidin-2-ylethanol has a molecular weight of 223.29 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-piperidin-2-ylethanol is sourced from PubChem (CID 79559666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).