ethane;methane;1,1,2,2-tetramethylcyclohexane

C16H40 — CID 144894499

IUPACethane;methane;1,1,2,2-tetramethylcyclohexane
SMILESC.C.CC.CC.CC1(C)CCCCC1(C)C
InChIInChI=1S/C10H20.2C2H6.2CH4/c1-9(2)7-5-6-8-10(9,3)4;2*1-2;;/h5-8H2,1-4H3;2*1-2H3;2*1H4
InChIKeyDLJRTWMPNKKQPO-UHFFFAOYSA-N
MW232.50 g/mol
LogP6.94
Rot. Bonds

About ethane;methane;1,1,2,2-tetramethylcyclohexane

ethane;methane;1,1,2,2-tetramethylcyclohexane (PubChem CID 144894499) has the molecular formula C16H40 and a molecular weight of 232.50 g/mol. Its IUPAC name is ethane;methane;1,1,2,2-tetramethylcyclohexane.

Molecular Properties

Compound Nameethane;methane;1,1,2,2-tetramethylcyclohexane
PubChem CID144894499
Molecular FormulaC16H40
Molecular Weight232.50 g/mol
Exact Mass232.31
IUPAC Nameethane;methane;1,1,2,2-tetramethylcyclohexane
SMILESC.C.CC.CC.CC1(C)CCCCC1(C)C
InChIInChI=1S/C10H20.2C2H6.2CH4/c1-9(2)7-5-6-8-10(9,3)4;2*1-2;;/h5-8H2,1-4H3;2*1-2H3;2*1H4
InChIKeyDLJRTWMPNKKQPO-UHFFFAOYSA-N
XLogP6.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500232.50
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1-fluoro-1-methylcycloheptane
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(1,2,2-trimethylcyclohexyl)methanediamine
CID 142614010
4,4-dimethyl-1-oxaspiro[2.5]octane
CID 11829539
CID 68784292
CID 68784292
1,2,2,7,7-pentamethylazepane
CID 22946774
1-(1-hydroxy-2,2-dimethylcyclohexyl)cycloheptane-1-carbonitrile
CID 79852706
1-(1-hydroxy-2,2-dimethylcyclohexyl)cyclobutane-1-carbonitrile
CID 79852266
1,1,7,7-tetramethylcyclopentadecane
CID 123360096
1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane
CID 158949227

Frequently Asked Questions

What is the IUPAC name of ethane;methane;1,1,2,2-tetramethylcyclohexane?
The IUPAC name of ethane;methane;1,1,2,2-tetramethylcyclohexane (CID 144894499) is ethane;methane;1,1,2,2-tetramethylcyclohexane.
What is the SMILES notation for ethane;methane;1,1,2,2-tetramethylcyclohexane?
The canonical SMILES for ethane;methane;1,1,2,2-tetramethylcyclohexane is C.C.CC.CC.CC1(C)CCCCC1(C)C.
What is the InChIKey of ethane;methane;1,1,2,2-tetramethylcyclohexane?
The InChIKey is DLJRTWMPNKKQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.2C2H6.2CH4/c1-9(2)7-5-6-8-10(9,3)4;2*1-2;;/h5-8H2,1-4H3;2*1-2H3;2*1H4.
What are the key properties of ethane;methane;1,1,2,2-tetramethylcyclohexane?
ethane;methane;1,1,2,2-tetramethylcyclohexane has a molecular weight of 232.50 g/mol, XLogP of 6.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;1,1,2,2-tetramethylcyclohexane is sourced from PubChem (CID 144894499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).