1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol

C16H24O2 — CID 55105917

IUPAC1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
SMILESCOc1ccc(C2(O)CCC(C(C)C)CC2)cc1
InChIInChI=1S/C16H24O2/c1-12(2)13-8-10-16(17,11-9-13)14-4-6-15(18-3)7-5-14/h4-7,12-13,17H,8-11H2,1-3H3
InChIKeyAEFCMGUXFPVAFQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.73
Rot. Bonds3

About 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol

1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol (PubChem CID 55105917) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
PubChem CID55105917
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
SMILESCOc1ccc(C2(O)CCC(C(C)C)CC2)cc1
InChIInChI=1S/C16H24O2/c1-12(2)13-8-10-16(17,11-9-13)14-4-6-15(18-3)7-5-14/h4-7,12-13,17H,8-11H2,1-3H3
InChIKeyAEFCMGUXFPVAFQ-UHFFFAOYSA-N
XLogP3.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63406811
4-propan-2-yl-1-(4-propylphenyl)cyclohexan-1-ol
CID 63406977
4-tert-butyl-1-(4-methoxyphenyl)cycloheptan-1-ol
CID 65094719
1-methoxy-4-[2-(4-methoxyphenyl)-1-methyl-4-propan-2-ylcyclohexyl]benzene
CID 167011620
8-(4-methoxyphenyl)spiro[4.5]decan-8-ol
CID 114819307
1-(4-ethylphenyl)-4-propan-2-ylcycloheptan-1-ol
CID 65090466
1-(4-methoxyphenyl)-3-methylcyclohexan-1-ol
CID 60794519
8-(4-methoxyphenyl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 10934332
4-(4-methoxyphenyl)oxepan-4-ol
CID 65079083
4-propan-2-yl-1-[3-(trifluoromethoxy)phenyl]cyclohexan-1-ol
CID 63407060
1-propan-2-yl-4-(4-propan-2-yloxyphenyl)piperidin-4-ol
CID 62795744
1-(2-fluoro-3-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 82805715

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol (CID 55105917) is 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol is COc1ccc(C2(O)CCC(C(C)C)CC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is AEFCMGUXFPVAFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-12(2)13-8-10-16(17,11-9-13)14-4-6-15(18-3)7-5-14/h4-7,12-13,17H,8-11H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol?
1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 55105917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).