1,2-dimethyl-3-pent-3-en-2-ylcyclobutane

C11H20 — CID 123364191

IUPAC1,2-dimethyl-3-pent-3-en-2-ylcyclobutane
SMILESCC=CC(C)C1CC(C)C1C
InChIInChI=1S/C11H20/c1-5-6-8(2)11-7-9(3)10(11)4/h5-6,8-11H,7H2,1-4H3
InChIKeyIXDBLCGXWZEISS-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.49
Rot. Bonds2

About 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane

1,2-dimethyl-3-pent-3-en-2-ylcyclobutane (PubChem CID 123364191) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane.

Molecular Properties

Compound Name1,2-dimethyl-3-pent-3-en-2-ylcyclobutane
PubChem CID123364191
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1,2-dimethyl-3-pent-3-en-2-ylcyclobutane
SMILESCC=CC(C)C1CC(C)C1C
InChIInChI=1S/C11H20/c1-5-6-8(2)11-7-9(3)10(11)4/h5-6,8-11H,7H2,1-4H3
InChIKeyIXDBLCGXWZEISS-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
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

1,2-dimethyl-3-pentan-2-ylcyclobutane
CID 123945019
1-(1-chloropropyl)-2,3-dimethylcyclobutane
CID 131133771
1-methyl-2-(4-methylpent-3-en-2-yl)cyclopropane
CID 123933645
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
1,2-dimethyl-3-(4-methylhexan-2-yl)cyclobutane
CID 123367002
1-methyl-2-(5-methylhex-3-en-2-yl)cyclobutane
CID 123373776
1-methyl-2-(5-methylhexan-2-yl)cyclopropane
CID 91344454
1-(1-iodoethyl)-2-methylcyclopropane
CID 118947064
1-(2,5-dimethylheptan-3-yl)-2,3-dimethylcyclobutane
CID 123429129
trans-(1S,4S)-1,2,3,4-tetramethylcyclopentane
CID 58443772
1-(2,3-dimethylcyclobutyl)butan-1-ol
CID 130831475

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane?
The IUPAC name of 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane (CID 123364191) is 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane.
What is the SMILES notation for 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane?
The canonical SMILES for 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane is CC=CC(C)C1CC(C)C1C.
What is the InChIKey of 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane?
The InChIKey is IXDBLCGXWZEISS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-5-6-8(2)11-7-9(3)10(11)4/h5-6,8-11H,7H2,1-4H3.
What are the key properties of 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane?
1,2-dimethyl-3-pent-3-en-2-ylcyclobutane has a molecular weight of 152.28 g/mol, XLogP of 3.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-pent-3-en-2-ylcyclobutane is sourced from PubChem (CID 123364191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).