1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol

C13H17FO — CID 144756929

IUPAC1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol
SMILESCC(c1cccc(F)c1)C1(O)CCCC1
InChIInChI=1S/C13H17FO/c1-10(13(15)7-2-3-8-13)11-5-4-6-12(14)9-11/h4-6,9-10,15H,2-3,7-8H2,1H3
InChIKeyNYIZWDKSHSCZOX-UHFFFAOYSA-N
MW208.28 g/mol
LogP3.23
Rot. Bonds2

About 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol

1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol (PubChem CID 144756929) has the molecular formula C13H17FO and a molecular weight of 208.28 g/mol. Its IUPAC name is 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol
PubChem CID144756929
Molecular FormulaC13H17FO
Molecular Weight208.28 g/mol
Exact Mass208.13
IUPAC Name1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol
SMILESCC(c1cccc(F)c1)C1(O)CCCC1
InChIInChI=1S/C13H17FO/c1-10(13(15)7-2-3-8-13)11-5-4-6-12(14)9-11/h4-6,9-10,15H,2-3,7-8H2,1H3
InChIKeyNYIZWDKSHSCZOX-UHFFFAOYSA-N
XLogP3.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-ethyl-1-[1-(3-fluorophenyl)ethyl]pyrrolidine-2-carboxylic acid
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2-[1-(3-fluorophenyl)cyclopentyl]propanoic acid
CID 68973973
1-[(3-fluorophenyl)-(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine
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1-[(3-fluorophenyl)-(methylamino)methyl]cyclopropane-1-carboxylic acid
CID 116958196
(1R,2R)-1-fluoro-1-(3-fluorophenyl)propan-2-ol
CID 122372146
tert-butyl 4-[2-(3-fluorophenyl)-2-(1-hydroxycyclohexyl)acetyl]piperazine-1-carboxylate
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(3-fluorophenyl)-(2-methylthiolan-2-yl)methanol
CID 105078411

Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol?
The IUPAC name of 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol (CID 144756929) is 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol is CC(c1cccc(F)c1)C1(O)CCCC1.
What is the InChIKey of 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol?
The InChIKey is NYIZWDKSHSCZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FO/c1-10(13(15)7-2-3-8-13)11-5-4-6-12(14)9-11/h4-6,9-10,15H,2-3,7-8H2,1H3.
What are the key properties of 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol?
1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol has a molecular weight of 208.28 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-fluorophenyl)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 144756929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).