2,3,4,6-tetramethylbicyclo[3.1.0]hexane

C10H18 — CID 91229213

IUPAC2,3,4,6-tetramethylbicyclo[3.1.0]hexane
SMILESCC1C(C)C2C(C)C2C1C
InChIInChI=1S/C10H18/c1-5-6(2)9-8(4)10(9)7(5)3/h5-10H,1-4H3
InChIKeyYKHHFSXEIPSSHC-UHFFFAOYSA-N
MW138.25 g/mol
LogP2.79
Rot. Bonds

About 2,3,4,6-tetramethylbicyclo[3.1.0]hexane

2,3,4,6-tetramethylbicyclo[3.1.0]hexane (PubChem CID 91229213) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 2,3,4,6-tetramethylbicyclo[3.1.0]hexane.

Molecular Properties

Compound Name2,3,4,6-tetramethylbicyclo[3.1.0]hexane
PubChem CID91229213
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name2,3,4,6-tetramethylbicyclo[3.1.0]hexane
SMILESCC1C(C)C2C(C)C2C1C
InChIInChI=1S/C10H18/c1-5-6(2)9-8(4)10(9)7(5)3/h5-10H,1-4H3
InChIKeyYKHHFSXEIPSSHC-UHFFFAOYSA-N
XLogP2.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,6-tetramethylbicyclo[3.1.0]hexane?
The IUPAC name of 2,3,4,6-tetramethylbicyclo[3.1.0]hexane (CID 91229213) is 2,3,4,6-tetramethylbicyclo[3.1.0]hexane.
What is the SMILES notation for 2,3,4,6-tetramethylbicyclo[3.1.0]hexane?
The canonical SMILES for 2,3,4,6-tetramethylbicyclo[3.1.0]hexane is CC1C(C)C2C(C)C2C1C.
What is the InChIKey of 2,3,4,6-tetramethylbicyclo[3.1.0]hexane?
The InChIKey is YKHHFSXEIPSSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-5-6(2)9-8(4)10(9)7(5)3/h5-10H,1-4H3.
What are the key properties of 2,3,4,6-tetramethylbicyclo[3.1.0]hexane?
2,3,4,6-tetramethylbicyclo[3.1.0]hexane has a molecular weight of 138.25 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,6-tetramethylbicyclo[3.1.0]hexane is sourced from PubChem (CID 91229213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).