2,6-dimethyl-4-propylbicyclo[3.1.0]hexane

C11H20 — CID 123147574

IUPAC2,6-dimethyl-4-propylbicyclo[3.1.0]hexane
SMILESCCCC1CC(C)C2C(C)C12
InChIInChI=1S/C11H20/c1-4-5-9-6-7(2)10-8(3)11(9)10/h7-11H,4-6H2,1-3H3
InChIKeyBJHAKVXIYMLRCC-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.32
Rot. Bonds2

About 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane

2,6-dimethyl-4-propylbicyclo[3.1.0]hexane (PubChem CID 123147574) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane.

Molecular Properties

Compound Name2,6-dimethyl-4-propylbicyclo[3.1.0]hexane
PubChem CID123147574
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name2,6-dimethyl-4-propylbicyclo[3.1.0]hexane
SMILESCCCC1CC(C)C2C(C)C12
InChIInChI=1S/C11H20/c1-4-5-9-6-7(2)10-8(3)11(9)10/h7-11H,4-6H2,1-3H3
InChIKeyBJHAKVXIYMLRCC-UHFFFAOYSA-N
XLogP3.32
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 ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-methyl-6-propylbicyclo[2.2.0]hexane
CID 123694094
1,2,4-trimethyl-5-propylcyclohexane
CID 20777497
ethene;1,2,3-trimethyl-4-propylcyclopentane
CID 162276276
ethane;1-methyl-2-propylcyclopropane
CID 144710386
ethane;1,2,4-trimethyl-5-propylcyclohexane
CID 156835083
4,4,5,5,9,10-hexamethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,8,8,9,9-pentamethyl-5-propyltricyclo[5.2.1.02,6]decane
CID 159252719
2-methyl-4-propylcyclobutan-1-ol
CID 91553284
3-methyl-5-propyltricyclo[5.2.1.02,6]decane-8,9-dicarboxylic acid
CID 20622006
acetylene;1-methyl-2-propylcyclopropane;propane
CID 173373842
2-methyl-1,3-dipropylcyclopentane
CID 90887551
2,5-dimethyl-4-propylcyclohexan-1-ol
CID 58534195
2,3,5-trimethyl-1-propylcycloheptane
CID 123381227

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane?
The IUPAC name of 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane (CID 123147574) is 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane.
What is the SMILES notation for 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane?
The canonical SMILES for 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane is CCCC1CC(C)C2C(C)C12.
What is the InChIKey of 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane?
The InChIKey is BJHAKVXIYMLRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-4-5-9-6-7(2)10-8(3)11(9)10/h7-11H,4-6H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane?
2,6-dimethyl-4-propylbicyclo[3.1.0]hexane has a molecular weight of 152.28 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-propylbicyclo[3.1.0]hexane is sourced from PubChem (CID 123147574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).