(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol

C16H23FO2 — CID 116753671

IUPAC(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol
SMILESCCOC1(C(O)c2cc(C)cc(F)c2)CCCCC1
InChIInChI=1S/C16H23FO2/c1-3-19-16(7-5-4-6-8-16)15(18)13-9-12(2)10-14(17)11-13/h9-11,15,18H,3-8H2,1-2H3
InChIKeyJDJUSLDGKXYSHN-UHFFFAOYSA-N
MW266.36 g/mol
LogP3.91
Rot. Bonds4

About (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol

(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol (PubChem CID 116753671) has the molecular formula C16H23FO2 and a molecular weight of 266.36 g/mol. Its IUPAC name is (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol
PubChem CID116753671
Molecular FormulaC16H23FO2
Molecular Weight266.36 g/mol
Exact Mass266.17
IUPAC Name(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol
SMILESCCOC1(C(O)c2cc(C)cc(F)c2)CCCCC1
InChIInChI=1S/C16H23FO2/c1-3-19-16(7-5-4-6-8-16)15(18)13-9-12(2)10-14(17)11-13/h9-11,15,18H,3-8H2,1-2H3
InChIKeyJDJUSLDGKXYSHN-UHFFFAOYSA-N
XLogP3.91
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3,5-difluorophenyl)-(1-ethoxycycloheptyl)methanol
CID 116756092
(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methanol
CID 116756160
(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
CID 116753621
(1-ethoxycycloheptyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128630
(1-ethoxycyclopentyl)-(4-methylphenyl)methanol
CID 116753072
(3,5-difluorophenyl)-(1-methoxycyclobutyl)methanol
CID 116710430
(2-chloro-5-fluorophenyl)-(1-ethoxycyclohexyl)methanol
CID 105394608
(2,4-dimethylphenyl)-(1-ethoxycyclohexyl)methanol
CID 116753536
[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
CID 105278518
1-(1-ethoxycyclohexyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 116753691
(4-chloro-2-fluorophenyl)-(1-ethoxycyclohexyl)methanol
CID 116753618
(3-bromo-2,6-difluorophenyl)-(1-ethoxycyclohexyl)methanol
CID 106942119

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol?
The IUPAC name of (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol (CID 116753671) is (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol?
The canonical SMILES for (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol is CCOC1(C(O)c2cc(C)cc(F)c2)CCCCC1.
What is the InChIKey of (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol?
The InChIKey is JDJUSLDGKXYSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FO2/c1-3-19-16(7-5-4-6-8-16)15(18)13-9-12(2)10-14(17)11-13/h9-11,15,18H,3-8H2,1-2H3.
What are the key properties of (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol?
(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol has a molecular weight of 266.36 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 116753671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).