cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane

C37H78O — CID 174801862

IUPACcyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane
SMILESC1CCCC1.C1CCCCC1.CC1CC1.CC1CCC1.CC1CCCC1.CCC(C)C.CCC1CC1.CO
InChIInChI=1S/2C6H12.3C5H10.C5H12.C4H8.CH4O/c1-6-4-2-3-5-6;1-2-4-6-5-3-1;1-5-3-2-4-5;1-2-5-3-4-5;1-2-4-5-3-1;1-4-5(2)3;1-4-2-3-4;1-2/h6H,2-5H2,1H3;1-6H2;2*5H,2-4H2,1H3;1-5H2;5H,4H2,1-3H3;4H,2-3H2,1H3;2H,1H3
InChIKeyDZCKLCVRMLICAV-UHFFFAOYSA-N
MW539.03 g/mol
LogP13.18
Rot. Bonds2

About cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane

cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane (PubChem CID 174801862) has the molecular formula C37H78O and a molecular weight of 539.03 g/mol. Its IUPAC name is cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane.

Molecular Properties

Compound Namecyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane
PubChem CID174801862
Molecular FormulaC37H78O
Molecular Weight539.03 g/mol
Exact Mass538.61
IUPAC Namecyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane
SMILESC1CCCC1.C1CCCCC1.CC1CC1.CC1CCC1.CC1CCCC1.CCC(C)C.CCC1CC1.CO
InChIInChI=1S/2C6H12.3C5H10.C5H12.C4H8.CH4O/c1-6-4-2-3-5-6;1-2-4-6-5-3-1;1-5-3-2-4-5;1-2-5-3-4-5;1-2-4-5-3-1;1-4-5(2)3;1-4-2-3-4;1-2/h6H,2-5H2,1H3;1-6H2;2*5H,2-4H2,1H3;1-5H2;5H,4H2,1-3H3;4H,2-3H2,1H3;2H,1H3
InChIKeyDZCKLCVRMLICAV-UHFFFAOYSA-N
XLogP13.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500539.03
LogP ≤ 513.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane with MolForge

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Related Compounds

4-ethyl-1,7-dimethylcyclododecane
CID 123234850
1-ethyl-4-methylcyclooctane;methane
CID 159989571
2-methylbutane;methylcyclobutane
CID 57473841
butane;2,2-dimethylbutane;(1R)-1,2-dimethylcyclopentane;2,2-dimethylpropane;ethane;ethylcyclobutane;ethylcyclopropane;methane;bis(2-methylbutane);methylcyclobutane;methylcyclopentane;methylcyclopropane;2-methylpropane;pentane;propane
CID 162066878
cyclobutane;ethane;ethylcyclobutane;methane;methylcyclobutane
CID 158476891
carbanide;ethylcyclopentane;methylcyclopentane;ruthenium(2+)
CID 162292868
1-ethyl-4-methylcyclohexane;2-methylprop-1-ene
CID 154678997
1-ethyl-4-methylcyclohexane;pentane
CID 159787850
1-ethyl-4-(4-methylcyclohexyl)cyclohexane
CID 19850420
1-ethyl-3-(2-methylpropyl)cyclobutane;1-ethyl-3-(2-methylpropyl)cycloheptane;1-ethyl-3-(2-methylpropyl)cyclohexane;1-ethyl-3-(2-methylpropyl)cyclopentane;1-methyl-3-(2-methylpropyl)cyclobutane;1-methyl-3-(2-methylpropyl)cycloheptane;1-methyl-3-(2-methylpropyl)cyclohexane;1-methyl-3-(2-methylpropyl)cyclopentane
CID 161373906
1-ethyl-4-propan-2-ylcyclohexane;propan-2-ylcycloheptane;propan-2-ylcyclopentane
CID 159304571
tris(ethylcyclopentane);gadolinium
CID 160752471

Frequently Asked Questions

What is the IUPAC name of cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane?
The IUPAC name of cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane (CID 174801862) is cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane.
What is the SMILES notation for cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane?
The canonical SMILES for cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane is C1CCCC1.C1CCCCC1.CC1CC1.CC1CCC1.CC1CCCC1.CCC(C)C.CCC1CC1.CO.
What is the InChIKey of cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane?
The InChIKey is DZCKLCVRMLICAV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H12.3C5H10.C5H12.C4H8.CH4O/c1-6-4-2-3-5-6;1-2-4-6-5-3-1;1-5-3-2-4-5;1-2-5-3-4-5;1-2-4-5-3-1;1-4-5(2)3;1-4-2-3-4;1-2/h6H,2-5H2,1H3;1-6H2;2*5H,2-4H2,1H3;1-5H2;5H,4H2,1-3H3;4H,2-3H2,1H3;2H,1H3.
What are the key properties of cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane?
cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane has a molecular weight of 539.03 g/mol, XLogP of 13.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane is sourced from PubChem (CID 174801862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).