3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol

C17H26O2 — CID 103432568

IUPAC3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
SMILESCCC1CCCC(O)(c2ccc(C)c(C)c2OC)C1
InChIInChI=1S/C17H26O2/c1-5-14-7-6-10-17(18,11-14)15-9-8-12(2)13(3)16(15)19-4/h8-9,14,18H,5-7,10-11H2,1-4H3
InChIKeyNWVYDDILUBKFFN-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.10
Rot. Bonds3

About 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol

3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol (PubChem CID 103432568) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
PubChem CID103432568
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
SMILESCCC1CCCC(O)(c2ccc(C)c(C)c2OC)C1
InChIInChI=1S/C17H26O2/c1-5-14-7-6-10-17(18,11-14)15-9-8-12(2)13(3)16(15)19-4/h8-9,14,18H,5-7,10-11H2,1-4H3
InChIKeyNWVYDDILUBKFFN-UHFFFAOYSA-N
XLogP4.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
CID 103432415
8-(2-methoxy-3,4-dimethylphenyl)spiro[4.5]decan-8-ol
CID 103432732
4-(2-methoxy-3,4-dimethylphenyl)-1-methylazepan-4-ol
CID 103432584
1-(2-methoxy-3,4-dimethylphenyl)-3,3-dimethylcyclopentan-1-ol
CID 103432648
3-ethyl-1-(3-methylthiophen-2-yl)cyclohexan-1-ol
CID 79991182
3-(2-methoxy-3,4-dimethylphenyl)-3-methylcyclopentan-1-ol
CID 103434384
1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol
CID 117336720
1-(2-methoxy-3,4-dimethylphenyl)-3-methylcyclohexan-1-amine
CID 103432752
2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
CID 103432445
1-(2,4-dimethylphenyl)-4-ethylcycloheptan-1-ol
CID 65085735
1-(2-methoxy-3,4-dimethylphenyl)-2-propan-2-ylcyclohexan-1-ol
CID 103432682
[1-(2-methoxy-3,4-dimethylphenyl)cyclopropyl]methanamine
CID 117293943

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol?
The IUPAC name of 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol (CID 103432568) is 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol.
What is the SMILES notation for 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol?
The canonical SMILES for 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol is CCC1CCCC(O)(c2ccc(C)c(C)c2OC)C1.
What is the InChIKey of 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol?
The InChIKey is NWVYDDILUBKFFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-5-14-7-6-10-17(18,11-14)15-9-8-12(2)13(3)16(15)19-4/h8-9,14,18H,5-7,10-11H2,1-4H3.
What are the key properties of 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol?
3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol has a molecular weight of 262.39 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol is sourced from PubChem (CID 103432568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).