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

C10H18 — CID 123385938

IUPAC1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane
SMILESC=C(C)CC1CC(C)C1C
InChIInChI=1S/C10H18/c1-7(2)5-10-6-8(3)9(10)4/h8-10H,1,5-6H2,2-4H3
InChIKeyYUTQVLPBXDKJHM-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.24
Rot. Bonds2

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

1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane (PubChem CID 123385938) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane.

Molecular Properties

Compound Name1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane
PubChem CID123385938
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane
SMILESC=C(C)CC1CC(C)C1C
InChIInChI=1S/C10H18/c1-7(2)5-10-6-8(3)9(10)4/h8-10H,1,5-6H2,2-4H3
InChIKeyYUTQVLPBXDKJHM-UHFFFAOYSA-N
XLogP3.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.24
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

1,4-dimethyl-2-(2-methylprop-2-enyl)cyclopentane
CID 123213374
trans-(1R,2R)-2-(2-methylprop-2-enyl)cyclohexan-1-ol
CID 71351318
ethane;1-ethyl-2,3-dimethylcyclobutane
CID 142059191
1,5-dimethyl-2-(3-methylbut-3-enyl)-4-propylcyclohexane
CID 123584713
4,8-bis(2-methylprop-2-enyl)tricyclo[5.2.1.02,6]decane
CID 156753274
1,2,5-trimethyl-3-prop-1-en-2-ylcyclohexane
CID 90909258
3-(2-methylprop-2-enyl)cycloheptan-1-ol
CID 79185632
ethene;1,2,3-trimethyl-4-propylcyclopentane
CID 162276276
1,2-dimethyl-3-[(2-propan-2-ylcyclobutyl)methyl]cyclobutane
CID 123443774
[(1R,2S,5S)-2-methyl-5-prop-1-en-2-ylcyclohexyl]methanol
CID 130848342
[4-ethyl-2-(2-methylprop-2-enyl)cyclohexyl]methanamine
CID 81012762
trans-(1R,2S)-1-methyl-2-[2-[(1R,2S)-2-methylcyclopropyl]ethyl]cyclopropane
CID 23638911

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The IUPAC name of 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane (CID 123385938) is 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane.
What is the SMILES notation for 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The canonical SMILES for 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane is C=C(C)CC1CC(C)C1C.
What is the InChIKey of 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane?
The InChIKey is YUTQVLPBXDKJHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-7(2)5-10-6-8(3)9(10)4/h8-10H,1,5-6H2,2-4H3.
What are the key properties of 1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane?
1,2-dimethyl-3-(2-methylprop-2-enyl)cyclobutane has a molecular weight of 138.25 g/mol, XLogP of 3.24, 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-(2-methylprop-2-enyl)cyclobutane is sourced from PubChem (CID 123385938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).