6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane

C11H20 — CID 140612172

IUPAC6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane
SMILESCC(C)(C)CC1C2CCCC21
InChIInChI=1S/C11H20/c1-11(2,3)7-10-8-5-4-6-9(8)10/h8-10H,4-7H2,1-3H3
InChIKeyLNTWAMWBPLCMCA-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.47
Rot. Bonds1

About 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane

6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane (PubChem CID 140612172) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane.

Molecular Properties

Compound Name6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane
PubChem CID140612172
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane
SMILESCC(C)(C)CC1C2CCCC21
InChIInChI=1S/C11H20/c1-11(2,3)7-10-8-5-4-6-9(8)10/h8-10H,4-7H2,1-3H3
InChIKeyLNTWAMWBPLCMCA-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7-(2,2-dimethylpropyl)bicyclo[2.2.1]heptane
CID 58592691
2,2-dimethylpropane;2,2-dimethylpropylcyclobutane
CID 167591215
cis-(1S,3R)-1-(2,2-dimethylpropyl)-3-methylcyclohexane
CID 158565558
tert-butylcyclobutane;tert-butylcyclopropane;2,2-dimethylpropylcyclopropane
CID 160715730
6-(2-methylpropyl)bicyclo[3.1.0]hexane
CID 154519615
6-(methoxymethyl)bicyclo[3.1.0]hexane
CID 147202482
2,2-dimethylpropylcyclobutane;ethane;bis(2-methylbutane)
CID 144526650
5-[3-(6-bicyclo[3.1.0]hexanyl)-2,2-dimethylpropyl]-2-tert-butyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 126657976
ethane;tricyclo[5.3.0.02,6]decane
CID 158606562
tert-butylcyclobutane;tert-butylcyclohexane;tert-butylcyclopentane;tert-butylcyclopropane;2,2-dimethylpropylcyclobutane;2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane
CID 161188745
2-(2,2-dimethylpropyl)-6-methyloxane
CID 163432444
3-(2,2-dimethylpropyl)cyclohexene
CID 19985552

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane?
The IUPAC name of 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane (CID 140612172) is 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane.
What is the SMILES notation for 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane?
The canonical SMILES for 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane is CC(C)(C)CC1C2CCCC21.
What is the InChIKey of 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane?
The InChIKey is LNTWAMWBPLCMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-11(2,3)7-10-8-5-4-6-9(8)10/h8-10H,4-7H2,1-3H3.
What are the key properties of 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane?
6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane has a molecular weight of 152.28 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylpropyl)bicyclo[3.1.0]hexane is sourced from PubChem (CID 140612172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).