2-(2-methylpropyl)bicyclo[1.1.0]butane

C8H14 — CID 123355318

IUPAC2-(2-methylpropyl)bicyclo[1.1.0]butane
SMILESCC(C)CC1C2CC12
InChIInChI=1S/C8H14/c1-5(2)3-6-7-4-8(6)7/h5-8H,3-4H2,1-2H3
InChIKeyZGBNPXMFIGBLQO-UHFFFAOYSA-N
MW110.20 g/mol
LogP2.30
Rot. Bonds2

About 2-(2-methylpropyl)bicyclo[1.1.0]butane

2-(2-methylpropyl)bicyclo[1.1.0]butane (PubChem CID 123355318) has the molecular formula C8H14 and a molecular weight of 110.20 g/mol. Its IUPAC name is 2-(2-methylpropyl)bicyclo[1.1.0]butane.

Molecular Properties

Compound Name2-(2-methylpropyl)bicyclo[1.1.0]butane
PubChem CID123355318
Molecular FormulaC8H14
Molecular Weight110.20 g/mol
Exact Mass110.11
IUPAC Name2-(2-methylpropyl)bicyclo[1.1.0]butane
SMILESCC(C)CC1C2CC12
InChIInChI=1S/C8H14/c1-5(2)3-6-7-4-8(6)7/h5-8H,3-4H2,1-2H3
InChIKeyZGBNPXMFIGBLQO-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-(2-methylpropyl)bicyclo[3.1.0]hexane
CID 154519615
2-methyl-3-(2-methylpropyl)bicyclo[2.2.1]heptane
CID 59941268
3-[[hydroxy(methyl)amino]methyl]-2-(2-methylpropyl)cyclobutan-1-ol
CID 146572732
1-ethyl-3-methyl-2-(2-methylpropyl)cyclobutane
CID 158664832
1,3-dimethyl-2-(2-methylpropyl)cyclohexane
CID 91143805
(3R)-2-(2-cyclopent-2-yn-1-ylpropyl)bicyclo[1.1.0]butane
CID 163710270
1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1,2,3,4,5-pentafluoro-6-(2-methylpropyl)cyclohexane
CID 164775045
2-bicyclo[1.1.0]butanylmethanol
CID 73001174
methane;bis([3-methyl-2-(2-methylpropyl)cyclobutyl]methanol)
CID 161111254
7-(2-methylpropyl)-6-azabicyclo[3.1.1]heptane
CID 146555370
N,N-dimethyl-1-[3-methyl-2-(2-methylpropyl)cyclobutyl]methanamine
CID 123374526

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)bicyclo[1.1.0]butane?
The IUPAC name of 2-(2-methylpropyl)bicyclo[1.1.0]butane (CID 123355318) is 2-(2-methylpropyl)bicyclo[1.1.0]butane.
What is the SMILES notation for 2-(2-methylpropyl)bicyclo[1.1.0]butane?
The canonical SMILES for 2-(2-methylpropyl)bicyclo[1.1.0]butane is CC(C)CC1C2CC12.
What is the InChIKey of 2-(2-methylpropyl)bicyclo[1.1.0]butane?
The InChIKey is ZGBNPXMFIGBLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14/c1-5(2)3-6-7-4-8(6)7/h5-8H,3-4H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)bicyclo[1.1.0]butane?
2-(2-methylpropyl)bicyclo[1.1.0]butane has a molecular weight of 110.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)bicyclo[1.1.0]butane is sourced from PubChem (CID 123355318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).