(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol

C17H26O2 — CID 63893975

IUPAC(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol
SMILESCCC1CCCCC1C(O)c1ccc(OC)c(C)c1
InChIInChI=1S/C17H26O2/c1-4-13-7-5-6-8-15(13)17(18)14-9-10-16(19-3)12(2)11-14/h9-11,13,15,17-18H,4-8H2,1-3H3
InChIKeyHYNKZUMDJLLXHD-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.25
Rot. Bonds4

About (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol

(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol (PubChem CID 63893975) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol.

Molecular Properties

Compound Name(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol
PubChem CID63893975
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol
SMILESCCC1CCCCC1C(O)c1ccc(OC)c(C)c1
InChIInChI=1S/C17H26O2/c1-4-13-7-5-6-8-15(13)17(18)14-9-10-16(19-3)12(2)11-14/h9-11,13,15,17-18H,4-8H2,1-3H3
InChIKeyHYNKZUMDJLLXHD-UHFFFAOYSA-N
XLogP4.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol?
The IUPAC name of (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol (CID 63893975) is (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol.
What is the SMILES notation for (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol?
The canonical SMILES for (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol is CCC1CCCCC1C(O)c1ccc(OC)c(C)c1.
What is the InChIKey of (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol?
The InChIKey is HYNKZUMDJLLXHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-4-13-7-5-6-8-15(13)17(18)14-9-10-16(19-3)12(2)11-14/h9-11,13,15,17-18H,4-8H2,1-3H3.
What are the key properties of (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol?
(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol has a molecular weight of 262.39 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol is sourced from PubChem (CID 63893975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).