(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol

C17H26O2 — CID 64738581

IUPAC(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol
SMILESCc1ccc([C@@H](C)O)c(OC2CCC(C)C(C)C2)c1
InChIInChI=1S/C17H26O2/c1-11-5-8-16(14(4)18)17(9-11)19-15-7-6-12(2)13(3)10-15/h5,8-9,12-15,18H,6-7,10H2,1-4H3/t12?,13?,14-,15?/m1/s1
InChIKeyUYUIIVTWIPPSGI-MIGSVPMKSA-N
MW262.39 g/mol
LogP4.25
Rot. Bonds3

About (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol

(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol (PubChem CID 64738581) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol
PubChem CID64738581
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol
SMILESCc1ccc([C@@H](C)O)c(OC2CCC(C)C(C)C2)c1
InChIInChI=1S/C17H26O2/c1-11-5-8-16(14(4)18)17(9-11)19-15-7-6-12(2)13(3)10-15/h5,8-9,12-15,18H,6-7,10H2,1-4H3/t12?,13?,14-,15?/m1/s1
InChIKeyUYUIIVTWIPPSGI-MIGSVPMKSA-N
XLogP4.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclopentyloxy-4-methylphenyl)ethanol
CID 63650282
1-[2-(3,4-dimethylcyclohexyl)oxyphenyl]ethanol
CID 64738983
(1S)-1-(2-cycloheptyloxy-4-methylphenyl)ethanol
CID 82928224
1-[4-methyl-2-(oxan-4-yloxy)phenyl]ethanol
CID 63935425
(1R)-1-[4-methyl-2-(oxan-3-yloxy)phenyl]ethanol
CID 107135084
1-[2-(1,1-dioxothiolan-3-yl)oxy-4-methylphenyl]ethanol
CID 55246678
3-(5-methyl-2-propan-2-ylphenoxy)cyclopentan-1-amine
CID 79643944
2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]cyclohexan-1-ol
CID 63651051
2-(3,4-dimethylcyclohexyl)oxy-5-methylbenzenecarbothioamide
CID 107929610
(1R)-1-[2-(3,4-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64744791
1-[4-methoxy-2-(4-methylcyclohexyl)oxyphenyl]ethanol
CID 82001479
(1S)-1-[4-methoxy-2-(3-methylcyclohexyl)oxyphenyl]ethanol
CID 82001110

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol?
The IUPAC name of (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol (CID 64738581) is (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol is Cc1ccc([C@@H](C)O)c(OC2CCC(C)C(C)C2)c1.
What is the InChIKey of (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol?
The InChIKey is UYUIIVTWIPPSGI-MIGSVPMKSA-N. The full InChI is InChI=1S/C17H26O2/c1-11-5-8-16(14(4)18)17(9-11)19-15-7-6-12(2)13(3)10-15/h5,8-9,12-15,18H,6-7,10H2,1-4H3/t12?,13?,14-,15?/m1/s1.
What are the key properties of (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol?
(1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol has a molecular weight of 262.39 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(3,4-dimethylcyclohexyl)oxy-4-methylphenyl]ethanol is sourced from PubChem (CID 64738581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).