3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol

C19H30O2 — CID 65445692

IUPAC3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol
SMILESCOc1ccc(CCC(O)C2CCC(C(C)C)CC2)cc1
InChIInChI=1S/C19H30O2/c1-14(2)16-7-9-17(10-8-16)19(20)13-6-15-4-11-18(21-3)12-5-15/h4-5,11-12,14,16-17,19-20H,6-10,13H2,1-3H3
InChIKeyGVWOIJAQLWMODF-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.45
Rot. Bonds6

About 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol

3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol (PubChem CID 65445692) has the molecular formula C19H30O2 and a molecular weight of 290.45 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol
PubChem CID65445692
Molecular FormulaC19H30O2
Molecular Weight290.45 g/mol
Exact Mass290.22
IUPAC Name3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol
SMILESCOc1ccc(CCC(O)C2CCC(C(C)C)CC2)cc1
InChIInChI=1S/C19H30O2/c1-14(2)16-7-9-17(10-8-16)19(20)13-6-15-4-11-18(21-3)12-5-15/h4-5,11-12,14,16-17,19-20H,6-10,13H2,1-3H3
InChIKeyGVWOIJAQLWMODF-UHFFFAOYSA-N
XLogP4.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclooctyl-3-(4-methoxyphenyl)propan-1-ol
CID 80603730
1-cyclopropyl-3-(3-methoxyphenyl)propan-1-ol
CID 63354159
(1R)-1-cyclopropyl-3-[4-(dimethylamino)phenyl]propan-1-ol
CID 129389562
1-iodo-3-(4-methoxyphenyl)propan-1-ol
CID 146274831
3-(4-ethoxyphenyl)-1-piperidin-4-ylpropan-1-ol
CID 112512841
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-3-(4-methoxyphenyl)propan-1-ol
CID 79968888
3-[2-(4-methoxyphenyl)ethyl]-4-methylpentan-2-ol
CID 79423809
1-cyclobutyl-3-(4-methoxyphenyl)propan-1-amine
CID 65446100
N-[(4-methoxyphenyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62702803
1-cyclopropyl-2-(4-propylphenoxy)ethanol
CID 63908083
1-cyclopropyl-5-(4-methoxyphenyl)pent-4-en-1-ol
CID 54479630
2-[(4-methoxyphenyl)methyl]-4-propan-2-ylcyclohexan-1-ol
CID 79422834

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol?
The IUPAC name of 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol (CID 65445692) is 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol.
What is the SMILES notation for 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol?
The canonical SMILES for 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol is COc1ccc(CCC(O)C2CCC(C(C)C)CC2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol?
The InChIKey is GVWOIJAQLWMODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30O2/c1-14(2)16-7-9-17(10-8-16)19(20)13-6-15-4-11-18(21-3)12-5-15/h4-5,11-12,14,16-17,19-20H,6-10,13H2,1-3H3.
What are the key properties of 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol?
3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol has a molecular weight of 290.45 g/mol, XLogP of 4.45, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)propan-1-ol is sourced from PubChem (CID 65445692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).