4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane

C15H28 — CID 123474375

IUPAC4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane
SMILESCCCC1(C)C(C)C2(CC)CC(C)C12C
InChIInChI=1S/C15H28/c1-7-9-13(5)12(4)15(8-2)10-11(3)14(13,15)6/h11-12H,7-10H2,1-6H3
InChIKeySQEHALNERYLPNN-UHFFFAOYSA-N
MW208.39 g/mol
LogP4.89
Rot. Bonds3

About 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane

4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane (PubChem CID 123474375) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane.

Molecular Properties

Compound Name4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane
PubChem CID123474375
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane
SMILESCCCC1(C)C(C)C2(CC)CC(C)C12C
InChIInChI=1S/C15H28/c1-7-9-13(5)12(4)15(8-2)10-11(3)14(13,15)6/h11-12H,7-10H2,1-6H3
InChIKeySQEHALNERYLPNN-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.39
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1,2,3-tetramethyl-2-propylcyclopropane
CID 90999525
1-ethyl-2-methyl-3-propylbicyclo[1.1.0]butane
CID 123467509
1-butyl-2-methyl-1-propylcyclopropane
CID 123815284
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
1-ethyl-1,2-dimethylcyclopropane
CID 524629
1-ethyl-1-(1-ethyl-2-methylcyclopropyl)cyclobutane
CID 123436733
1-ethyl-2,5-dimethyl-1-propylcyclopentane
CID 145269100
2,3-dimethyl-2-propyloxetane
CID 89191195
1,2,2,3,4,6-hexamethylbicyclo[2.2.0]hexane
CID 91324406
1-ethyl-2,3,3,4,5-pentamethylbicyclo[3.1.0]hexane
CID 123592730
1,2-dimethyl-1-pentan-2-ylcyclopropane
CID 91541433
1-ethyl-1,2,5-trimethylcyclohexane
CID 123642131

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane?
The IUPAC name of 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane (CID 123474375) is 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane.
What is the SMILES notation for 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane?
The canonical SMILES for 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane is CCCC1(C)C(C)C2(CC)CC(C)C12C.
What is the InChIKey of 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane?
The InChIKey is SQEHALNERYLPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-7-9-13(5)12(4)15(8-2)10-11(3)14(13,15)6/h11-12H,7-10H2,1-6H3.
What are the key properties of 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane?
4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane has a molecular weight of 208.39 g/mol, XLogP of 4.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2,3,6-tetramethyl-2-propylbicyclo[2.2.0]hexane is sourced from PubChem (CID 123474375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).