2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane

C11H20 — CID 91250319

IUPAC2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane
SMILESC=C1CC(C(C)(C)CC)C1C
InChIInChI=1S/C11H20/c1-6-11(4,5)10-7-8(2)9(10)3/h9-10H,2,6-7H2,1,3-5H3
InChIKeyUHJYXLSSOQTWID-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.63
Rot. Bonds2

About 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane

2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane (PubChem CID 91250319) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane.

Molecular Properties

Compound Name2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane
PubChem CID91250319
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane
SMILESC=C1CC(C(C)(C)CC)C1C
InChIInChI=1S/C11H20/c1-6-11(4,5)10-7-8(2)9(10)3/h9-10H,2,6-7H2,1,3-5H3
InChIKeyUHJYXLSSOQTWID-UHFFFAOYSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane?
The IUPAC name of 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane (CID 91250319) is 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane.
What is the SMILES notation for 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane?
The canonical SMILES for 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane is C=C1CC(C(C)(C)CC)C1C.
What is the InChIKey of 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane?
The InChIKey is UHJYXLSSOQTWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-6-11(4,5)10-7-8(2)9(10)3/h9-10H,2,6-7H2,1,3-5H3.
What are the key properties of 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane?
2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane has a molecular weight of 152.28 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylbutan-2-yl)-3-methylidenecyclobutane is sourced from PubChem (CID 91250319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).