(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane

C89H186 — CID 162229638

IUPAC(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane
SMILESCC(C)C1CCC1.CC(C)C1CCCC1.CC1C(C)(C)CCCC1(C)C.CC1CCC(C)(C)CC1.CC1CCCC(C)C1C.CC1CCCC[C@H]1C.CCC(CC)CC.CCCC(C)(C)C.CCCCC(C)C.CCC[C@H](C)CC.C[C@@H]1CCCCC1(C)C
InChIInChI=1S/C11H22.3C9H18.2C8H16.C7H14.4C7H16/c1-9-10(2,3)7-6-8-11(9,4)5;1-8-4-6-9(2,3)7-5-8;1-8-6-4-5-7-9(8,2)3;1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7;1-5-6-7(2,3)4;1-4-5-6-7(2)3;1-4-6-7(3)5-2;1-4-7(5-2)6-3/h9H,6-8H2,1-5H3;2*8H,4-7H2,1-3H3;7-9H,4-6H2,1-3H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;5-6H2,1-4H3;3*7H,4-6H2,1-3H3/t;;8-;;7-,8?;;;;;7-;/m..1.1....1./s1
InChIKeyZVFYFZOXUJPHBS-OAOKMNLZSA-N
MW1256.47 g/mol
LogP32.82
Rot. Bonds12

About (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane

(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane (PubChem CID 162229638) has the molecular formula C89H186 and a molecular weight of 1256.47 g/mol. Its IUPAC name is (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane.

Molecular Properties

Compound Name(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane
PubChem CID162229638
Molecular FormulaC89H186
Molecular Weight1256.47 g/mol
Exact Mass1255.46
IUPAC Name(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane
SMILESCC(C)C1CCC1.CC(C)C1CCCC1.CC1C(C)(C)CCCC1(C)C.CC1CCC(C)(C)CC1.CC1CCCC(C)C1C.CC1CCCC[C@H]1C.CCC(CC)CC.CCCC(C)(C)C.CCCCC(C)C.CCC[C@H](C)CC.C[C@@H]1CCCCC1(C)C
InChIInChI=1S/C11H22.3C9H18.2C8H16.C7H14.4C7H16/c1-9-10(2,3)7-6-8-11(9,4)5;1-8-4-6-9(2,3)7-5-8;1-8-6-4-5-7-9(8,2)3;1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7;1-5-6-7(2,3)4;1-4-5-6-7(2)3;1-4-6-7(3)5-2;1-4-7(5-2)6-3/h9H,6-8H2,1-5H3;2*8H,4-7H2,1-3H3;7-9H,4-6H2,1-3H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;5-6H2,1-4H3;3*7H,4-6H2,1-3H3/t;;8-;;7-,8?;;;;;7-;/m..1.1....1./s1
InChIKeyZVFYFZOXUJPHBS-OAOKMNLZSA-N
XLogP32.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms89
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001256.47
LogP ≤ 532.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane with MolForge

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Related Compounds

(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;heptane;bis(2-methylhexane);3-methylhexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane
CID 159141613
(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;heptane;methane;bis(2-methylhexane);(3R)-3-methylhexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane
CID 159815001
2,2-dimethylbutane;(1R)-1,2-dimethylcyclopentane;methylcyclohexane;bis(2-methylpentane);3-methylpentane;1,1,2,3,3-pentamethylcyclopentane;propylcyclopropane;1,2,3-trimethylcyclopentane;1,2,4-trimethylcyclopentane;(2R)-1,1,2-trimethylcyclopentane
CID 158361454
2,2-dimethylbutane;(1R)-1,2-dimethylcyclopentane;bis(2-methylpentane);3-methylpentane;1,1,2,3,3-pentamethylcyclopentane;propylcyclopropane;1,2,3-trimethylcyclopentane;1,2,4-trimethylcyclopentane;(2R)-1,1,2-trimethylcyclopentane
CID 159734682
1,1-dimethylcyclobutane;1,3-dimethylcyclobutane;(2R)-1,2-dimethylcyclobutane;ethylcyclobutane;1-ethyl-2-methylcyclopropane;heptane;methylcyclopentane;bis(2-methylhexane);(3R)-3-methylhexane;(2S)-2-methylspiro[2.2]pentane;1,1,2-trimethylcyclopropane
CID 163827956
2,5-dimethylhexane;bis(2,2-dimethylpentane);2,4-dimethylpentane;(3S)-2,3-dimethylpentane;heptane;methylcyclopentane;2-methylhexane;3-methylhexane;(3R)-3-methylhexane;2,2,3-trimethylbutane
CID 158558499
(1R)-1,2-dimethylcyclopentane;(3R)-1,3-dimethylcyclopentane;2,2-dimethylpentane;bis(2,3-dimethylpentane);bis(3,3-dimethylpentane);3-ethylpentane;methylcyclohexane;bis(3-methylhexane);bis(2,2,3-trimethylbutane)
CID 158686402
3,3-dimethyloctan-2-ylcyclopentane;6-ethyl-3-methylnonane
CID 143367876
bis(1-ethyl-1-methylcyclopentane);1-ethyl-2-methylcyclopentane;propan-2-ylcyclopentane;propylcyclopentane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;1,2,3-trimethylcyclopentane;1,2,4-trimethylcyclopentane;(2S)-1,1,2-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane
CID 163579621
(2S)-1,2-dimethylbicyclo[2.2.1]heptane;1,1,3,3,5,5-hexamethylcyclohexane;1,1,2,3,3-pentamethylcyclohexane;1,1,3,3,5-pentamethylcyclohexane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane
CID 167712089
butan-2-ylcyclobutane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane
CID 163608316
(1R)-1,2-dimethylcyclopentane;bis(2,3-dimethylpentane);bis(3,3-dimethylpentane);3-ethylpentane;methylcyclohexane;3-methylhexane;bis(2,2,3-trimethylbutane)
CID 163993832

Frequently Asked Questions

What is the IUPAC name of (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane?
The IUPAC name of (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane (CID 162229638) is (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane.
What is the SMILES notation for (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane?
The canonical SMILES for (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane is CC(C)C1CCC1.CC(C)C1CCCC1.CC1C(C)(C)CCCC1(C)C.CC1CCC(C)(C)CC1.CC1CCCC(C)C1C.CC1CCCC[C@H]1C.CCC(CC)CC.CCCC(C)(C)C.CCCCC(C)C.CCC[C@H](C)CC.C[C@@H]1CCCCC1(C)C.
What is the InChIKey of (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane?
The InChIKey is ZVFYFZOXUJPHBS-OAOKMNLZSA-N. The full InChI is InChI=1S/C11H22.3C9H18.2C8H16.C7H14.4C7H16/c1-9-10(2,3)7-6-8-11(9,4)5;1-8-4-6-9(2,3)7-5-8;1-8-6-4-5-7-9(8,2)3;1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7;1-5-6-7(2,3)4;1-4-5-6-7(2)3;1-4-6-7(3)5-2;1-4-7(5-2)6-3/h9H,6-8H2,1-5H3;2*8H,4-7H2,1-3H3;7-9H,4-6H2,1-3H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3;5-6H2,1-4H3;3*7H,4-6H2,1-3H3/t;;8-;;7-,8?;;;;;7-;/m..1.1....1./s1.
What are the key properties of (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane?
(2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane has a molecular weight of 1256.47 g/mol, XLogP of 32.82, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-dimethylcyclohexane;2,2-dimethylpentane;3-ethylpentane;2-methylhexane;(3R)-3-methylhexane;1,1,2,3,3-pentamethylcyclohexane;propan-2-ylcyclobutane;propan-2-ylcyclopentane;1,1,4-trimethylcyclohexane;1,2,3-trimethylcyclohexane;(2R)-1,1,2-trimethylcyclohexane is sourced from PubChem (CID 162229638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).