(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol

C16H23FO2 — CID 106881183

IUPAC(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol
SMILESCOC1(C(O)c2c(C)cc(C)cc2F)CCCCC1
InChIInChI=1S/C16H23FO2/c1-11-9-12(2)14(13(17)10-11)15(18)16(19-3)7-5-4-6-8-16/h9-10,15,18H,4-8H2,1-3H3
InChIKeyWTSGFCKARFFUCA-UHFFFAOYSA-N
MW266.36 g/mol
LogP3.83
Rot. Bonds3

About (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol

(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol (PubChem CID 106881183) has the molecular formula C16H23FO2 and a molecular weight of 266.36 g/mol. Its IUPAC name is (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol.

Molecular Properties

Compound Name(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol
PubChem CID106881183
Molecular FormulaC16H23FO2
Molecular Weight266.36 g/mol
Exact Mass266.17
IUPAC Name(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol
SMILESCOC1(C(O)c2c(C)cc(C)cc2F)CCCCC1
InChIInChI=1S/C16H23FO2/c1-11-9-12(2)14(13(17)10-11)15(18)16(19-3)7-5-4-6-8-16/h9-10,15,18H,4-8H2,1-3H3
InChIKeyWTSGFCKARFFUCA-UHFFFAOYSA-N
XLogP3.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-methoxycyclobutyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106680299
[1-(dimethylamino)cyclopentyl]-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106881107
(2,4-dimethylphenyl)-(1-methoxycycloheptyl)methanol
CID 116755770
(3-fluoro-4-methylphenyl)-(1-methoxycyclopentyl)methanol
CID 107128604
(2,5-difluorophenyl)-(1-methoxycycloheptyl)methanol
CID 116756000
(2-fluorophenyl)-(1-methoxycycloheptyl)methanol
CID 116755788
(1-methoxycyclohexyl)-(5-methylthiophen-3-yl)methanol
CID 116753501
1-[hydroxy-(2-methoxy-4,6-dimethylphenyl)methyl]cyclohexan-1-ol
CID 106680334
[1-(dimethylamino)-3-methylcyclohexyl]-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106881112
(3,5-difluorophenyl)-(1-methoxycyclobutyl)methanol
CID 116710430
(1-methoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753417
(2-fluoro-4-methoxyphenyl)-(1-methoxycyclopentyl)methanol
CID 103395478

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol?
The IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol (CID 106881183) is (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol.
What is the SMILES notation for (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol?
The canonical SMILES for (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol is COC1(C(O)c2c(C)cc(C)cc2F)CCCCC1.
What is the InChIKey of (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol?
The InChIKey is WTSGFCKARFFUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FO2/c1-11-9-12(2)14(13(17)10-11)15(18)16(19-3)7-5-4-6-8-16/h9-10,15,18H,4-8H2,1-3H3.
What are the key properties of (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol?
(2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol has a molecular weight of 266.36 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4,6-dimethylphenyl)-(1-methoxycyclohexyl)methanol is sourced from PubChem (CID 106881183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).