2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene

C24H42 — CID 58552713

IUPAC2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SMILESC1CCC(CCC2CC3CCCCC3CC2C2CCCCC2)CC1
InChIInChI=1S/C24H42/c1-3-9-19(10-4-1)15-16-23-17-21-13-7-8-14-22(21)18-24(23)20-11-5-2-6-12-20/h19-24H,1-18H2
InChIKeyRUZZMUUREMTBLC-UHFFFAOYSA-N
MW330.60 g/mol
LogP7.76
Rot. Bonds4

About 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene

2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene (PubChem CID 58552713) has the molecular formula C24H42 and a molecular weight of 330.60 g/mol. Its IUPAC name is 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene.

Molecular Properties

Compound Name2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
PubChem CID58552713
Molecular FormulaC24H42
Molecular Weight330.60 g/mol
Exact Mass330.33
IUPAC Name2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SMILESC1CCC(CCC2CC3CCCCC3CC2C2CCCCC2)CC1
InChIInChI=1S/C24H42/c1-3-9-19(10-4-1)15-16-23-17-21-13-7-8-14-22(21)18-24(23)20-11-5-2-6-12-20/h19-24H,1-18H2
InChIKeyRUZZMUUREMTBLC-UHFFFAOYSA-N
XLogP7.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.60
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene with MolForge

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Related Compounds

2-cyclohexyl-1-(2-cyclohexylethyl)-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 58552522
3-(2-cycloheptylethyl)-2,3,4,4a,5,6,7,8,9,10,11,11a-dodecahydro-1H-benzo[9]annulene
CID 90780974
2-(2-methylcyclopropyl)ethylcyclohexane
CID 91503845
2-(2-cyclohexylethyl)cyclopropan-1-amine
CID 131112009
6-(2-cyclohexylethyl)bicyclo[3.2.1]octane
CID 171097692
2-(2-cyclopropylethyl)bicyclo[3.1.0]hexane
CID 154516067
3-ethyltricyclo[4.3.1.12,5]undecane
CID 163995336
9-(2-cyclohexylethyl)tetracyclo[6.2.1.13,6.02,7]dodec-4-ene;9-cyclohexyltetracyclo[6.2.1.13,6.02,7]dodec-4-ene;9-decyltetracyclo[6.2.1.13,6.02,7]dodec-4-ene
CID 160562835
2-(2-cyclopentylcyclopropyl)ethanamine
CID 83826413
2-(2-cyclohexylethyl)-1,4-dimethylcyclohexane
CID 154060560
(4S)-1-cyclohexyl-2,3-difluoro-4-[2-[4-[(1R,4S)-3-fluoro-4-iodocyclohexyl]cyclohexyl]ethyl]cyclohexane
CID 90437153
1-cyclohexyl-6-propylcyclodecane
CID 58552139

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The IUPAC name of 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene (CID 58552713) is 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene.
What is the SMILES notation for 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The canonical SMILES for 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene is C1CCC(CCC2CC3CCCCC3CC2C2CCCCC2)CC1.
What is the InChIKey of 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The InChIKey is RUZZMUUREMTBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H42/c1-3-9-19(10-4-1)15-16-23-17-21-13-7-8-14-22(21)18-24(23)20-11-5-2-6-12-20/h19-24H,1-18H2.
What are the key properties of 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene has a molecular weight of 330.60 g/mol, XLogP of 7.76, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3-(2-cyclohexylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene is sourced from PubChem (CID 58552713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).