2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane

C13H24 — CID 123282497

IUPAC2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane
SMILESC=CC(C)(C)C1(C)CC1C(C)CC
InChIInChI=1S/C13H24/c1-7-10(3)11-9-13(11,6)12(4,5)8-2/h8,10-11H,2,7,9H2,1,3-6H3
InChIKeyULINOSXMVLKISG-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.27
Rot. Bonds4

About 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane

2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane (PubChem CID 123282497) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane.

Molecular Properties

Compound Name2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane
PubChem CID123282497
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane
SMILESC=CC(C)(C)C1(C)CC1C(C)CC
InChIInChI=1S/C13H24/c1-7-10(3)11-9-13(11,6)12(4,5)8-2/h8,10-11H,2,7,9H2,1,3-6H3
InChIKeyULINOSXMVLKISG-UHFFFAOYSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.27
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

2-butan-2-yl-1-but-3-en-2-yl-5-methylcyclohexan-1-ol
CID 142319676
(2-butan-2-yl-1-methylcyclopropyl)-trimethylazanium
CID 123785816
2-butan-2-yl-1-methyl-1-pentylcyclopropane
CID 123764144
1-(2,3-dimethylpentan-3-yl)-1,2-dimethylcyclopropane
CID 123741342
1-(2,2-dimethylpropyl)-1-methyl-2-pentan-3-ylcyclopropane
CID 123698002
1-methyl-1-(3-methylpent-1-en-3-yl)-2-propylcyclopropane
CID 91067141
3-butan-2-yl-N-(4-ethyl-2-methylhex-5-en-2-yl)-N,2,2-trimethylcyclopropan-1-amine
CID 129252687
2-butan-2-yl-1-methyl-1-propylcyclobutane
CID 145223890
4-butan-2-yl-2-ethenyl-2-methyl-1,3-dioxolane
CID 89076469
1-(2,3-dimethylpentan-2-yl)-1-methylcyclobutane
CID 123373940
3-ethyl-4,4,5-trimethylhex-1-ene
CID 22107331
4-ethenyl-3,5-dimethylheptane
CID 90755259

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane?
The IUPAC name of 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane (CID 123282497) is 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane.
What is the SMILES notation for 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane?
The canonical SMILES for 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane is C=CC(C)(C)C1(C)CC1C(C)CC.
What is the InChIKey of 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane?
The InChIKey is ULINOSXMVLKISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-7-10(3)11-9-13(11,6)12(4,5)8-2/h8,10-11H,2,7,9H2,1,3-6H3.
What are the key properties of 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane?
2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane has a molecular weight of 180.33 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-1-methyl-1-(2-methylbut-3-en-2-yl)cyclopropane is sourced from PubChem (CID 123282497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).