1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

C20H30O — CID 64730675

IUPAC1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCC1CC(C)CC(C(C)(O)c2ccc3c(c2)CCCC3)C1
InChIInChI=1S/C20H30O/c1-14-10-15(2)12-19(11-14)20(3,21)18-9-8-16-6-4-5-7-17(16)13-18/h8-9,13-15,19,21H,4-7,10-12H2,1-3H3
InChIKeyGRGIWSPRMUTBHS-UHFFFAOYSA-N
MW286.46 g/mol
LogP4.85
Rot. Bonds2

About 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (PubChem CID 64730675) has the molecular formula C20H30O and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.

Molecular Properties

Compound Name1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
PubChem CID64730675
Molecular FormulaC20H30O
Molecular Weight286.46 g/mol
Exact Mass286.23
IUPAC Name1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCC1CC(C)CC(C(C)(O)c2ccc3c(c2)CCCC3)C1
InChIInChI=1S/C20H30O/c1-14-10-15(2)12-19(11-14)20(3,21)18-9-8-16-6-4-5-7-17(16)13-18/h8-9,13-15,19,21H,4-7,10-12H2,1-3H3
InChIKeyGRGIWSPRMUTBHS-UHFFFAOYSA-N
XLogP4.85
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 114194209
1-(4-chlorophenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 63406681
5-tert-butyl-2,3-dihydro-1H-indene
CID 15271758
1-(3,5-dimethylcyclohexyl)-1-(furan-3-yl)ethanol
CID 115467343
3-tert-butylbicyclo[4.2.0]octa-1(6),2,4-triene
CID 15438926
1-(1-methylpyrazol-3-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 103130101
6-(1,1-difluoro-2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 116841362
1-(3,5-dimethylcyclohexyl)-1-(5-fluoro-3-pyridinyl)ethanol
CID 114080710
6,6,6-trifluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yl)hexan-2-ol
CID 115515280
2-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,2-diamine
CID 3052971
(2R,3R,4S,5S)-2-amino-5-[(1S)-1-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-1-hydroxyethyl]oxolane-3,4-diol
CID 166912873
N-[(2R)-2-hydroxy-2-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]acetamide
CID 101124562

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The IUPAC name of 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (CID 64730675) is 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.
What is the SMILES notation for 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The canonical SMILES for 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is CC1CC(C)CC(C(C)(O)c2ccc3c(c2)CCCC3)C1.
What is the InChIKey of 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The InChIKey is GRGIWSPRMUTBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30O/c1-14-10-15(2)12-19(11-14)20(3,21)18-9-8-16-6-4-5-7-17(16)13-18/h8-9,13-15,19,21H,4-7,10-12H2,1-3H3.
What are the key properties of 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol has a molecular weight of 286.46 g/mol, XLogP of 4.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylcyclohexyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is sourced from PubChem (CID 64730675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).