ethane;methane;methylcyclohexane;methylcyclopentane

C23H58 — CID 158993326

IUPACethane;methane;methylcyclohexane;methylcyclopentane
SMILESC.C.CC.CC.CC.CC.CC1CCCC1.CC1CCCCC1
InChIInChI=1S/C7H14.C6H12.4C2H6.2CH4/c1-7-5-3-2-4-6-7;1-6-4-2-3-5-6;4*1-2;;/h7H,2-6H2,1H3;6H,2-5H2,1H3;4*1-2H3;2*1H4
InChIKeyJQKYCJUHCIMQLF-UHFFFAOYSA-N
MW334.72 g/mol
LogP10.16
Rot. Bonds

About ethane;methane;methylcyclohexane;methylcyclopentane

ethane;methane;methylcyclohexane;methylcyclopentane (PubChem CID 158993326) has the molecular formula C23H58 and a molecular weight of 334.72 g/mol. Its IUPAC name is ethane;methane;methylcyclohexane;methylcyclopentane.

Molecular Properties

Compound Nameethane;methane;methylcyclohexane;methylcyclopentane
PubChem CID158993326
Molecular FormulaC23H58
Molecular Weight334.72 g/mol
Exact Mass334.45
IUPAC Nameethane;methane;methylcyclohexane;methylcyclopentane
SMILESC.C.CC.CC.CC.CC.CC1CCCC1.CC1CCCCC1
InChIInChI=1S/C7H14.C6H12.4C2H6.2CH4/c1-7-5-3-2-4-6-7;1-6-4-2-3-5-6;4*1-2;;/h7H,2-6H2,1H3;6H,2-5H2,1H3;4*1-2H3;2*1H4
InChIKeyJQKYCJUHCIMQLF-UHFFFAOYSA-N
XLogP10.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.72
LogP ≤ 510.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Decylcyclohexane
CID 15713
Cyclohexane, tetradecyl-
CID 15715
Tridecylcyclohexane
CID 22327
Undecylcyclohexane
CID 40997
Dodecylcyclohexane
CID 15714
1-Cyclohexyloctadecane
CID 20514
Hexadecylcyclohexane
CID 23250
Cyclohexane, eicosyl-
CID 20511
Cyclopentane, heneicosyl-
CID 23171
Pentadecylcyclohexane
CID 22328
Cyclopentane, (4-octyldodecyl)-
CID 294710
Heptadecylcyclohexane
CID 29777

Frequently Asked Questions

What is the IUPAC name of ethane;methane;methylcyclohexane;methylcyclopentane?
The IUPAC name of ethane;methane;methylcyclohexane;methylcyclopentane (CID 158993326) is ethane;methane;methylcyclohexane;methylcyclopentane.
What is the SMILES notation for ethane;methane;methylcyclohexane;methylcyclopentane?
The canonical SMILES for ethane;methane;methylcyclohexane;methylcyclopentane is C.C.CC.CC.CC.CC.CC1CCCC1.CC1CCCCC1.
What is the InChIKey of ethane;methane;methylcyclohexane;methylcyclopentane?
The InChIKey is JQKYCJUHCIMQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.C6H12.4C2H6.2CH4/c1-7-5-3-2-4-6-7;1-6-4-2-3-5-6;4*1-2;;/h7H,2-6H2,1H3;6H,2-5H2,1H3;4*1-2H3;2*1H4.
What are the key properties of ethane;methane;methylcyclohexane;methylcyclopentane?
ethane;methane;methylcyclohexane;methylcyclopentane has a molecular weight of 334.72 g/mol, XLogP of 10.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;methylcyclohexane;methylcyclopentane is sourced from PubChem (CID 158993326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).