2,3-dimethyltricyclo[2.1.0.02,5]pentane

C7H10 — CID 123959749

IUPAC2,3-dimethyltricyclo[2.1.0.02,5]pentane
SMILESCC1C2C3C2C13C
InChIInChI=1S/C7H10/c1-3-4-5-6(4)7(3,5)2/h3-6H,1-2H3
InChIKeySKWMICYDYMGSBD-UHFFFAOYSA-N
MW94.16 g/mol
LogP1.52
Rot. Bonds

About 2,3-dimethyltricyclo[2.1.0.02,5]pentane

2,3-dimethyltricyclo[2.1.0.02,5]pentane (PubChem CID 123959749) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is 2,3-dimethyltricyclo[2.1.0.02,5]pentane.

Molecular Properties

Compound Name2,3-dimethyltricyclo[2.1.0.02,5]pentane
PubChem CID123959749
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Name2,3-dimethyltricyclo[2.1.0.02,5]pentane
SMILESCC1C2C3C2C13C
InChIInChI=1S/C7H10/c1-3-4-5-6(4)7(3,5)2/h3-6H,1-2H3
InChIKeySKWMICYDYMGSBD-UHFFFAOYSA-N
XLogP1.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methylcubane
CID 13245707
1,3,4,6,9,10-hexamethylpentacyclo[5.4.0.02,11.03,10.05,8]undecane
CID 123739870
(2R,3S,6R,7S,9R)-4-methylpentacyclo[4.3.0.02,5.03,8.04,7]nonan-9-ol
CID 124910900
2,2,3,4,5-pentamethylpyrrolidine
CID 55288380
(2S,3S,6R,7S,9S)-4-methylpentacyclo[4.3.0.02,5.03,8.04,7]nonan-9-ol
CID 98554845
4,5,6,9,10,11-hexamethylhexacyclo[6.4.0.01,10.02,5.02,7.03,12]dodecane
CID 174043765
1,2,3-trimethylcyclopropan-1-ol
CID 91184731
2,4,6,8,9,10-hexamethyladamantane
CID 58325503
(4-methyl-9-pentacyclo[4.3.0.02,4.03,8.05,7]nonanyl) acetate
CID 131855065
2-methylbicyclo[1.1.1]pentan-1-amine
CID 123370149
1,2,3,4,5,6,6,7,7,8-decamethyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene
CID 21348432
2-ethyl-2,3,5-trimethylbicyclo[2.1.0]pentane
CID 123929300

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyltricyclo[2.1.0.02,5]pentane?
The IUPAC name of 2,3-dimethyltricyclo[2.1.0.02,5]pentane (CID 123959749) is 2,3-dimethyltricyclo[2.1.0.02,5]pentane.
What is the SMILES notation for 2,3-dimethyltricyclo[2.1.0.02,5]pentane?
The canonical SMILES for 2,3-dimethyltricyclo[2.1.0.02,5]pentane is CC1C2C3C2C13C.
What is the InChIKey of 2,3-dimethyltricyclo[2.1.0.02,5]pentane?
The InChIKey is SKWMICYDYMGSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10/c1-3-4-5-6(4)7(3,5)2/h3-6H,1-2H3.
What are the key properties of 2,3-dimethyltricyclo[2.1.0.02,5]pentane?
2,3-dimethyltricyclo[2.1.0.02,5]pentane has a molecular weight of 94.16 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyltricyclo[2.1.0.02,5]pentane is sourced from PubChem (CID 123959749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).