2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene

C24H58 — CID 143356436

IUPAC2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene
SMILESC=C(C)C.CC.CC.CC.CC.CC(C)(C)C.CCC1CCCC1
InChIInChI=1S/C7H14.C5H12.C4H8.4C2H6/c1-2-7-5-3-4-6-7;1-5(2,3)4;1-4(2)3;4*1-2/h7H,2-6H2,1H3;1-4H3;1H2,2-3H3;4*1-2H3
InChIKeyBJLSNGZGBOVYHL-UHFFFAOYSA-N
MW346.73 g/mol
LogP10.33
Rot. Bonds1

About 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene

2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene (PubChem CID 143356436) has the molecular formula C24H58 and a molecular weight of 346.73 g/mol. Its IUPAC name is 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene.

Molecular Properties

Compound Name2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene
PubChem CID143356436
Molecular FormulaC24H58
Molecular Weight346.73 g/mol
Exact Mass346.45
IUPAC Name2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene
SMILESC=C(C)C.CC.CC.CC.CC.CC(C)(C)C.CCC1CCCC1
InChIInChI=1S/C7H14.C5H12.C4H8.4C2H6/c1-2-7-5-3-4-6-7;1-5(2,3)4;1-4(2)3;4*1-2/h7H,2-6H2,1H3;1-4H3;1H2,2-3H3;4*1-2H3
InChIKeyBJLSNGZGBOVYHL-UHFFFAOYSA-N
XLogP10.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.73
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

ethane;bis(ethylcyclopentane)
CID 158911237
ethane;ethene;ethylcyclobutane
CID 164586585
ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
CID 160752471
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
chromium;bis(ethylcyclopentane)
CID 91996240
ethylcycloheptane;2-methylprop-2-enoic acid
CID 68583536
magnesium;carbanide;bis(ethylcyclopentane)
CID 121233150
ethylcyclopentane;methanamine
CID 142068671
carbanide;bis(ethylcyclopentane);tungsten dihydride
CID 164887185
1-ethyl-4-methylcyclohexane;2-methylprop-1-ene
CID 154678997
ethylcyclobutane;tris(2-methylprop-2-enoic acid)
CID 67802354

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene?
The IUPAC name of 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene (CID 143356436) is 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene.
What is the SMILES notation for 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene?
The canonical SMILES for 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene is C=C(C)C.CC.CC.CC.CC.CC(C)(C)C.CCC1CCCC1.
What is the InChIKey of 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene?
The InChIKey is BJLSNGZGBOVYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.C5H12.C4H8.4C2H6/c1-2-7-5-3-4-6-7;1-5(2,3)4;1-4(2)3;4*1-2/h7H,2-6H2,1H3;1-4H3;1H2,2-3H3;4*1-2H3.
What are the key properties of 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene?
2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene has a molecular weight of 346.73 g/mol, XLogP of 10.33, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropane;ethane;ethylcyclopentane;2-methylprop-1-ene is sourced from PubChem (CID 143356436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).