1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol

C19H28O2 — CID 107429676

IUPAC1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1CCCC(O)(c2cccc(OC3CC3)c2)C1
InChIInChI=1S/C19H28O2/c1-14(2)11-15-5-4-10-19(20,13-15)16-6-3-7-18(12-16)21-17-8-9-17/h3,6-7,12,14-15,17,20H,4-5,8-11,13H2,1-2H3
InChIKeyZUWGDNOYRPZGDI-UHFFFAOYSA-N
MW288.43 g/mol
LogP4.65
Rot. Bonds5

About 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol

1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol (PubChem CID 107429676) has the molecular formula C19H28O2 and a molecular weight of 288.43 g/mol. Its IUPAC name is 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
PubChem CID107429676
Molecular FormulaC19H28O2
Molecular Weight288.43 g/mol
Exact Mass288.21
IUPAC Name1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1CCCC(O)(c2cccc(OC3CC3)c2)C1
InChIInChI=1S/C19H28O2/c1-14(2)11-15-5-4-10-19(20,13-15)16-6-3-7-18(12-16)21-17-8-9-17/h3,6-7,12,14-15,17,20H,4-5,8-11,13H2,1-2H3
InChIKeyZUWGDNOYRPZGDI-UHFFFAOYSA-N
XLogP4.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dichlorophenyl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429754
4-(3-cyclopropyloxyphenyl)-1-methylazepan-4-ol
CID 114520909
3-(2-methylpropyl)-1-(3-propan-2-yloxyphenyl)cyclohexan-1-amine
CID 107430117
1-(3-methoxyphenyl)-3-methylcyclohexan-1-ol
CID 60794651
1-(2-cyclobutylphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429613
1-(2-fluoro-4-methoxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429701
1-[1-(3-cyclopropyloxyphenyl)cyclopropyl]ethanamine
CID 117309977
1-(2-fluoro-4,6-dimethylphenyl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429597
1-(3-bromofuran-2-yl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429867
2-(3-cyclopropyloxyphenyl)-2-propan-2-ylazepane
CID 114521875
[1-(3-methoxyanilino)-3-(2-methylpropyl)cyclohexyl]methanol
CID 107430208
1-(cyclohepten-1-yl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429787

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol?
The IUPAC name of 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol (CID 107429676) is 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol?
The canonical SMILES for 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol is CC(C)CC1CCCC(O)(c2cccc(OC3CC3)c2)C1.
What is the InChIKey of 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol?
The InChIKey is ZUWGDNOYRPZGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28O2/c1-14(2)11-15-5-4-10-19(20,13-15)16-6-3-7-18(12-16)21-17-8-9-17/h3,6-7,12,14-15,17,20H,4-5,8-11,13H2,1-2H3.
What are the key properties of 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol?
1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol has a molecular weight of 288.43 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyloxyphenyl)-3-(2-methylpropyl)cyclohexan-1-ol is sourced from PubChem (CID 107429676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).