(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane

C10H18 — CID 123730639

IUPAC(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane
SMILESC[C@@H]1C2C([C@@H]1C)[C@H](C)[C@H]2C
InChIInChI=1S/C10H18/c1-5-6(2)10-8(4)7(3)9(5)10/h5-10H,1-4H3/t5-,6-,7-,8+,9?,10?/m1/s1
InChIKeyWCDAANTZITUWHE-RMJMHHOKSA-N
MW138.25 g/mol
LogP2.79
Rot. Bonds

About (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane

(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane (PubChem CID 123730639) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane.

Molecular Properties

Compound Name(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane
PubChem CID123730639
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane
SMILESC[C@@H]1C2C([C@@H]1C)[C@H](C)[C@H]2C
InChIInChI=1S/C10H18/c1-5-6(2)10-8(4)7(3)9(5)10/h5-10H,1-4H3/t5-,6-,7-,8+,9?,10?/m1/s1
InChIKeyWCDAANTZITUWHE-RMJMHHOKSA-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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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane?
The IUPAC name of (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane (CID 123730639) is (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane.
What is the SMILES notation for (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane?
The canonical SMILES for (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane is C[C@@H]1C2C([C@@H]1C)[C@H](C)[C@H]2C.
What is the InChIKey of (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane?
The InChIKey is WCDAANTZITUWHE-RMJMHHOKSA-N. The full InChI is InChI=1S/C10H18/c1-5-6(2)10-8(4)7(3)9(5)10/h5-10H,1-4H3/t5-,6-,7-,8+,9?,10?/m1/s1.
What are the key properties of (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane?
(2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]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 (2R,3S,5R,6R)-2,3,5,6-tetramethylbicyclo[2.2.0]hexane is sourced from PubChem (CID 123730639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).