(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol

C15H21FO — CID 107128518

IUPAC(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol
SMILESCCC1CCC(C(O)c2ccc(C)c(F)c2)C1
InChIInChI=1S/C15H21FO/c1-3-11-5-7-12(8-11)15(17)13-6-4-10(2)14(16)9-13/h4,6,9,11-12,15,17H,3,5,7-8H2,1-2H3
InChIKeyGQOXIMIAPYWGOD-UHFFFAOYSA-N
MW236.33 g/mol
LogP3.99
Rot. Bonds3

About (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol

(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol (PubChem CID 107128518) has the molecular formula C15H21FO and a molecular weight of 236.33 g/mol. Its IUPAC name is (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol
PubChem CID107128518
Molecular FormulaC15H21FO
Molecular Weight236.33 g/mol
Exact Mass236.16
IUPAC Name(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol
SMILESCCC1CCC(C(O)c2ccc(C)c(F)c2)C1
InChIInChI=1S/C15H21FO/c1-3-11-5-7-12(8-11)15(17)13-6-4-10(2)14(16)9-13/h4,6,9,11-12,15,17H,3,5,7-8H2,1-2H3
InChIKeyGQOXIMIAPYWGOD-UHFFFAOYSA-N
XLogP3.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-ethylcyclopentyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanol
CID 107288500
(3-ethylcyclopentyl)-(4-methoxyphenyl)methanol
CID 65409565
2,3-dihydro-1H-inden-2-yl-(3-fluoro-4-methylphenyl)methanol
CID 107128521
(2,4-difluoro-5-methylphenyl)-(4-ethylcyclohexyl)methanol
CID 115807295
(3-ethylcyclopentyl)-(4-fluorophenyl)methanamine
CID 65410226
2-cyclopropyl-N-ethyl-1-(3-fluoro-4-methylphenyl)ethanamine
CID 64906377
4-ethyl-2-(3-fluoro-4-methylphenoxy)cyclohexan-1-ol
CID 107170256
N-[(3,4-dimethylphenyl)-(3-ethylcyclopentyl)methyl]ethanamine
CID 65411811
(3-ethylcyclohexyl)-(4-methylsulfanylphenyl)methanol
CID 115808482
1-(3-fluoro-4-methylphenyl)butane-1,2-diol
CID 107128649
(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol
CID 65424893
[4-bromo-3-(trifluoromethyl)phenyl]-(3-ethylcyclohexyl)methanol
CID 115808455

Frequently Asked Questions

What is the IUPAC name of (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol?
The IUPAC name of (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol (CID 107128518) is (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol.
What is the SMILES notation for (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol?
The canonical SMILES for (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol is CCC1CCC(C(O)c2ccc(C)c(F)c2)C1.
What is the InChIKey of (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol?
The InChIKey is GQOXIMIAPYWGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FO/c1-3-11-5-7-12(8-11)15(17)13-6-4-10(2)14(16)9-13/h4,6,9,11-12,15,17H,3,5,7-8H2,1-2H3.
What are the key properties of (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol?
(3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol has a molecular weight of 236.33 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylcyclopentyl)-(3-fluoro-4-methylphenyl)methanol is sourced from PubChem (CID 107128518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).