(2R)-1,1,2,5,5-pentamethylcyclohexane

C11H22 — CID 147149776

IUPAC(2R)-1,1,2,5,5-pentamethylcyclohexane
SMILESC[C@@H]1CCC(C)(C)CC1(C)C
InChIInChI=1S/C11H22/c1-9-6-7-10(2,3)8-11(9,4)5/h9H,6-8H2,1-5H3/t9-/m1/s1
InChIKeyBTTOMARVQIOTJF-SECBINFHSA-N
MW154.30 g/mol
LogP3.86
Rot. Bonds

About (2R)-1,1,2,5,5-pentamethylcyclohexane

(2R)-1,1,2,5,5-pentamethylcyclohexane (PubChem CID 147149776) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is (2R)-1,1,2,5,5-pentamethylcyclohexane.

Molecular Properties

Compound Name(2R)-1,1,2,5,5-pentamethylcyclohexane
PubChem CID147149776
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name(2R)-1,1,2,5,5-pentamethylcyclohexane
SMILESC[C@@H]1CCC(C)(C)CC1(C)C
InChIInChI=1S/C11H22/c1-9-6-7-10(2,3)8-11(9,4)5/h9H,6-8H2,1-5H3/t9-/m1/s1
InChIKeyBTTOMARVQIOTJF-SECBINFHSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3,3,4-tetramethylcyclohexan-1-ol
CID 14446238
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
2-tert-butyl-1,1,5,5-tetramethylcyclohexane
CID 91142167
2,2,4,4-tetramethylcyclohexane-1-carbonyl chloride
CID 169447512
1,1-dimethylcyclobutane;1,1-dimethylcyclohexane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane;1,1,2-trimethylcyclopropane
CID 158329208
1,1,2-trimethylcycloundecane
CID 544748
(1R)-1,2-dimethylcyclobutan-1-amine
CID 147198625
CID 18798545
CID 18798545
(4R)-2,3,7-trimethylspiro[3.3]heptane-2-thiol
CID 138516988
2,2,4,4-tetramethylcyclooctane-1-thiol
CID 89408985
5,5-bis(3-ethylpentan-3-ylperoxy)-1,1,2-trimethylcyclohexane
CID 101294788
(2S)-1,1,2-trimethylcyclopropane
CID 25022262

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1,2,5,5-pentamethylcyclohexane?
The IUPAC name of (2R)-1,1,2,5,5-pentamethylcyclohexane (CID 147149776) is (2R)-1,1,2,5,5-pentamethylcyclohexane.
What is the SMILES notation for (2R)-1,1,2,5,5-pentamethylcyclohexane?
The canonical SMILES for (2R)-1,1,2,5,5-pentamethylcyclohexane is C[C@@H]1CCC(C)(C)CC1(C)C.
What is the InChIKey of (2R)-1,1,2,5,5-pentamethylcyclohexane?
The InChIKey is BTTOMARVQIOTJF-SECBINFHSA-N. The full InChI is InChI=1S/C11H22/c1-9-6-7-10(2,3)8-11(9,4)5/h9H,6-8H2,1-5H3/t9-/m1/s1.
What are the key properties of (2R)-1,1,2,5,5-pentamethylcyclohexane?
(2R)-1,1,2,5,5-pentamethylcyclohexane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1,2,5,5-pentamethylcyclohexane is sourced from PubChem (CID 147149776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).