cyclohexane;2,2-dimethylpentane;ethane

C15H34 — CID 162252162

IUPACcyclohexane;2,2-dimethylpentane;ethane
SMILESC1CCCCC1.CC.CCCC(C)(C)C
InChIInChI=1S/C7H16.C6H12.C2H6/c1-5-6-7(2,3)4;1-2-4-6-5-3-1;1-2/h5-6H2,1-4H3;1-6H2;1-2H3
InChIKeyZYCXNZHNGYGKFF-UHFFFAOYSA-N
MW214.44 g/mol
LogP6.20
Rot. Bonds1

About cyclohexane;2,2-dimethylpentane;ethane

cyclohexane;2,2-dimethylpentane;ethane (PubChem CID 162252162) has the molecular formula C15H34 and a molecular weight of 214.44 g/mol. Its IUPAC name is cyclohexane;2,2-dimethylpentane;ethane.

Molecular Properties

Compound Namecyclohexane;2,2-dimethylpentane;ethane
PubChem CID162252162
Molecular FormulaC15H34
Molecular Weight214.44 g/mol
Exact Mass214.27
IUPAC Namecyclohexane;2,2-dimethylpentane;ethane
SMILESC1CCCCC1.CC.CCCC(C)(C)C
InChIInChI=1S/C7H16.C6H12.C2H6/c1-5-6-7(2,3)4;1-2-4-6-5-3-1;1-2/h5-6H2,1-4H3;1-6H2;1-2H3
InChIKeyZYCXNZHNGYGKFF-UHFFFAOYSA-N
XLogP6.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500214.44
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 11551
2,2,5,5-Tetramethylhexane
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Cyclohexane;3,3-diethylpentane;ethane;propane
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2,2-Dimethyl-1,6-ditritiohexane
CID 59049149
Cyclohexane;3,3-dimethylpentane;ethane
CID 90910773
Cyclohexane;2,2-dimethylpropane;ethane
CID 91094358
2-Methanidyl-2-methylhexane
CID 91131818
Cyclohexane;3,3-dimethylpentane;ethane
CID 91200875
Cyclohexane;2,2-dimethylbutane;ethane;propane
CID 91201757
CID 91343697
CID 91343697
1,1-Dimethylcyclohexane;ethane
CID 91473980
1,1,1,2,2-Pentadeuterio-5,5-dimethylhexane
CID 140679837

Frequently Asked Questions

What is the IUPAC name of cyclohexane;2,2-dimethylpentane;ethane?
The IUPAC name of cyclohexane;2,2-dimethylpentane;ethane (CID 162252162) is cyclohexane;2,2-dimethylpentane;ethane.
What is the SMILES notation for cyclohexane;2,2-dimethylpentane;ethane?
The canonical SMILES for cyclohexane;2,2-dimethylpentane;ethane is C1CCCCC1.CC.CCCC(C)(C)C.
What is the InChIKey of cyclohexane;2,2-dimethylpentane;ethane?
The InChIKey is ZYCXNZHNGYGKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16.C6H12.C2H6/c1-5-6-7(2,3)4;1-2-4-6-5-3-1;1-2/h5-6H2,1-4H3;1-6H2;1-2H3.
What are the key properties of cyclohexane;2,2-dimethylpentane;ethane?
cyclohexane;2,2-dimethylpentane;ethane has a molecular weight of 214.44 g/mol, XLogP of 6.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;2,2-dimethylpentane;ethane is sourced from PubChem (CID 162252162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).