(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol

C16H24O3 — CID 106828269

IUPAC(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
SMILESCOc1ccc(OC)c(C(O)C2(C)CCCCC2)c1
InChIInChI=1S/C16H24O3/c1-16(9-5-4-6-10-16)15(17)13-11-12(18-2)7-8-14(13)19-3/h7-8,11,15,17H,4-6,9-10H2,1-3H3
InChIKeyNIHVMTFNJWOPAZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.71
Rot. Bonds4

About (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol

(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol (PubChem CID 106828269) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
PubChem CID106828269
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
SMILESCOc1ccc(OC)c(C(O)C2(C)CCCCC2)c1
InChIInChI=1S/C16H24O3/c1-16(9-5-4-6-10-16)15(17)13-11-12(18-2)7-8-14(13)19-3/h7-8,11,15,17H,4-6,9-10H2,1-3H3
InChIKeyNIHVMTFNJWOPAZ-UHFFFAOYSA-N
XLogP3.71
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2,5-dimethoxyphenyl)-hydroxymethyl]cyclopentan-1-ol
CID 103448378
(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
CID 79067398
[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol
CID 79134964
(2-chloro-4,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106828309
(3,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106830959
(2,4-dimethoxyphenyl)-[1-(dimethylamino)cyclohexyl]methanol
CID 79061364
amino-(2,5-dimethoxyphenyl)methanol
CID 116939586
[(2,5-dimethoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253483
(1-methoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753417
[1-(dimethylamino)cycloheptyl]-(2-methoxy-5-methylphenyl)methanol
CID 79063099
1-[(2,4-dimethoxyphenyl)-hydroxymethyl]cyclohexane-1-carbonitrile
CID 79136305
(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-ol
CID 10420642

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol?
The IUPAC name of (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol (CID 106828269) is (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol.
What is the SMILES notation for (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol?
The canonical SMILES for (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol is COc1ccc(OC)c(C(O)C2(C)CCCCC2)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol?
The InChIKey is NIHVMTFNJWOPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-16(9-5-4-6-10-16)15(17)13-11-12(18-2)7-8-14(13)19-3/h7-8,11,15,17H,4-6,9-10H2,1-3H3.
What are the key properties of (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol?
(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol has a molecular weight of 264.37 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol is sourced from PubChem (CID 106828269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).