[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol

C16H24O4 — CID 15752535

IUPAC[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol
SMILESCOc1cc(CO)cc(OC)c1OCC1CCCCC1
InChIInChI=1S/C16H24O4/c1-18-14-8-13(10-17)9-15(19-2)16(14)20-11-12-6-4-3-5-7-12/h8-9,12,17H,3-7,10-11H2,1-2H3
InChIKeyCMWWGMYUWKSGQZ-UHFFFAOYSA-N
MW280.36 g/mol
LogP3.16
Rot. Bonds6

About [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol

[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol (PubChem CID 15752535) has the molecular formula C16H24O4 and a molecular weight of 280.36 g/mol. Its IUPAC name is [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol.

Molecular Properties

Compound Name[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol
PubChem CID15752535
Molecular FormulaC16H24O4
Molecular Weight280.36 g/mol
Exact Mass280.17
IUPAC Name[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol
SMILESCOc1cc(CO)cc(OC)c1OCC1CCCCC1
InChIInChI=1S/C16H24O4/c1-18-14-8-13(10-17)9-15(19-2)16(14)20-11-12-6-4-3-5-7-12/h8-9,12,17H,3-7,10-11H2,1-2H3
InChIKeyCMWWGMYUWKSGQZ-UHFFFAOYSA-N
XLogP3.16
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(cyclobutylmethoxy)-3,5-dimethoxyphenyl]methanol
CID 65458991
[3-chloro-4-(cyclopentylmethoxy)-5-methoxyphenyl]methanol
CID 61343380
1-[4-(cyclopentylmethoxy)-3,5-dimethoxyphenyl]-N-methylmethanamine
CID 61342425
1-bromo-5-(chloromethyl)-2-(cyclohexylmethoxy)-3-methoxybenzene
CID 43622731
1-[4-(cyclopentylmethoxy)-3,5-dimethoxyphenyl]propan-2-amine
CID 61343582
1-bromo-5-(bromomethyl)-2-(cyclopentylmethoxy)-3-methoxybenzene
CID 63535191
[4-(cyclobutylmethoxy)-3,5-dimethylphenyl]methanol
CID 65457601
1-chloro-5-(chloromethyl)-2-(cyclobutylmethoxy)-3-methoxybenzene
CID 65460365
5-(bromomethyl)-1-chloro-2-(cyclopentylmethoxy)-3-methoxybenzene
CID 63536015
[3-bromo-4-(cyclobutylmethoxy)-5-ethoxyphenyl]methanol
CID 65459217
[3-chloro-4-(cyclopentylmethoxy)-5-methoxyphenyl]methanamine
CID 61344623
[3,5-dibromo-4-(cyclobutylmethoxy)phenyl]methanol
CID 107738957

Frequently Asked Questions

What is the IUPAC name of [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol?
The IUPAC name of [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol (CID 15752535) is [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol.
What is the SMILES notation for [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol?
The canonical SMILES for [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol is COc1cc(CO)cc(OC)c1OCC1CCCCC1.
What is the InChIKey of [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol?
The InChIKey is CMWWGMYUWKSGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O4/c1-18-14-8-13(10-17)9-15(19-2)16(14)20-11-12-6-4-3-5-7-12/h8-9,12,17H,3-7,10-11H2,1-2H3.
What are the key properties of [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol?
[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol has a molecular weight of 280.36 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol is sourced from PubChem (CID 15752535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).