1,2,3,3,4,4-hexamethylcyclobutene

C10H18 — CID 21059265

IUPAC1,2,3,3,4,4-hexamethylcyclobutene
SMILESCC1=C(C)C(C)(C)C1(C)C
InChIInChI=1S/C10H18/c1-7-8(2)10(5,6)9(7,3)4/h1-6H3
InChIKeyOPPDKRHIIDWPBO-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.39
Rot. Bonds

About 1,2,3,3,4,4-hexamethylcyclobutene

1,2,3,3,4,4-hexamethylcyclobutene (PubChem CID 21059265) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 1,2,3,3,4,4-hexamethylcyclobutene.

Molecular Properties

Compound Name1,2,3,3,4,4-hexamethylcyclobutene
PubChem CID21059265
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name1,2,3,3,4,4-hexamethylcyclobutene
SMILESCC1=C(C)C(C)(C)C1(C)C
InChIInChI=1S/C10H18/c1-7-8(2)10(5,6)9(7,3)4/h1-6H3
InChIKeyOPPDKRHIIDWPBO-UHFFFAOYSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2,3,3,4,4-hexamethylcyclobutene 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

1,2,3,4,5,6-Hexamethylbicyclo(2,2,0)hexa-2,5-diene
CID 24278
1,2,4,4-Tetramethylcyclopentene
CID 144123
Cyclobutane,1,1,2,2-tetramethyl-3,4-bis(1-methylethylidene)-
CID 136913
2-Hexene, 2,3,5,5-tetramethyl-
CID 141765
Cyclopentene, 1,2,3,3,4-pentamethyl-
CID 579269
1,2,3,3-Tetramethylcyclopentene
CID 14141137
Cyclobutene, 1,2,3,4-tetramethyl-
CID 565395
Octamethyl-1,3-cyclohexadiene
CID 600938
Octamethylcyclopentene
CID 13293893
2-Hexene, 2,3,4,4-tetramethyl-
CID 106741
2,3,5,5,6-Pentamethyl-2,6-heptadiene
CID 21718911
1,1-Dimethyl-2-(1-methylethylidene)-cyclopentane
CID 85980835

Frequently Asked Questions

What is the IUPAC name of 1,2,3,3,4,4-hexamethylcyclobutene?
The IUPAC name of 1,2,3,3,4,4-hexamethylcyclobutene (CID 21059265) is 1,2,3,3,4,4-hexamethylcyclobutene.
What is the SMILES notation for 1,2,3,3,4,4-hexamethylcyclobutene?
The canonical SMILES for 1,2,3,3,4,4-hexamethylcyclobutene is CC1=C(C)C(C)(C)C1(C)C.
What is the InChIKey of 1,2,3,3,4,4-hexamethylcyclobutene?
The InChIKey is OPPDKRHIIDWPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-7-8(2)10(5,6)9(7,3)4/h1-6H3.
What are the key properties of 1,2,3,3,4,4-hexamethylcyclobutene?
1,2,3,3,4,4-hexamethylcyclobutene has a molecular weight of 138.25 g/mol, XLogP of 3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3,4,4-hexamethylcyclobutene is sourced from PubChem (CID 21059265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).