1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane

C11H20 — CID 171620103

IUPAC1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane
SMILESC=C(C)CC1(C)CC(C)(C)C1
InChIInChI=1S/C11H20/c1-9(2)6-11(5)7-10(3,4)8-11/h1,6-8H2,2-5H3
InChIKeyGAYVIKPFIKHLHK-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds2

About 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane

1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane (PubChem CID 171620103) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane.

Molecular Properties

Compound Name1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane
PubChem CID171620103
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane
SMILESC=C(C)CC1(C)CC(C)(C)C1
InChIInChI=1S/C11H20/c1-9(2)6-11(5)7-10(3,4)8-11/h1,6-8H2,2-5H3
InChIKeyGAYVIKPFIKHLHK-UHFFFAOYSA-N
XLogP3.78
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 ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-hydroxy-3,3,5,5-tetramethyl-2-(2-methylprop-2-enyl)cyclopentan-1-one
CID 13146899
2,2-dimethyl-5,5-bis(2-methylprop-2-enyl)-1,3-dioxane-4,6-dione
CID 538939
dichloroplatinum;2,5-dimethylhexa-1,5-diene
CID 161462927
2-methyl-2-(3-methylbut-3-enyl)-1,3-dioxolane
CID 130120416
3-fluoro-3-(2-methylprop-2-enyl)azetidine
CID 122239981
1-butyl-1,3,3-trimethylcyclobutane
CID 91249753
5-methyl-5-(2-methylprop-2-enyl)oxolan-2-ol
CID 15853902
1-(2-methylprop-2-enyl)cyclobutane-1-carbaldehyde
CID 131051528
3-ethyl-3-(2-methylprop-2-enyl)oxetane
CID 89146557
1-methyl-N-(3-methylbut-3-enyl)cyclopropan-1-amine
CID 114472570
6-fluoro-4,4-dimethyl-6-(2-methylprop-2-enyl)cyclohex-2-en-1-one
CID 14665462
1,1,2-trimethyl-2-prop-1-en-2-ylcyclopropane
CID 123266453

Frequently Asked Questions

What is the IUPAC name of 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The IUPAC name of 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane (CID 171620103) is 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane.
What is the SMILES notation for 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The canonical SMILES for 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane is C=C(C)CC1(C)CC(C)(C)C1.
What is the InChIKey of 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The InChIKey is GAYVIKPFIKHLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-9(2)6-11(5)7-10(3,4)8-11/h1,6-8H2,2-5H3.
What are the key properties of 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane?
1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane has a molecular weight of 152.28 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-trimethyl-3-(2-methylprop-2-enyl)cyclobutane is sourced from PubChem (CID 171620103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).