(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene

C8H12 — CID 149263121

IUPAC(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene
SMILESC[C@@H]1CCC2=C1CC2
InChIInChI=1S/C8H12/c1-6-2-3-7-4-5-8(6)7/h6H,2-5H2,1H3/t6-/m1/s1
InChIKeyXPPWORVCYULDNT-ZCFIWIBFSA-N
MW108.18 g/mol
LogP2.51
Rot. Bonds

About (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene

(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene (PubChem CID 149263121) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene.

Molecular Properties

Compound Name(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene
PubChem CID149263121
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene
SMILESC[C@@H]1CCC2=C1CC2
InChIInChI=1S/C8H12/c1-6-2-3-7-4-5-8(6)7/h6H,2-5H2,1H3/t6-/m1/s1
InChIKeyXPPWORVCYULDNT-ZCFIWIBFSA-N
XLogP2.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-cyclopropylidene-2-methylcyclopentane
CID 154517244
4-methyl-2,3,4,5,6,7-hexahydroinden-1-one
CID 12604194
2-bicyclo[3.2.0]hept-1(5)-enylmethanol
CID 130331549
(2R,3S)-2,3-dimethylbicyclo[2.2.0]hex-1(4)-ene
CID 102070910
1-methyl-2-methylidenecyclobutane
CID 20800914
3-methyl-6-propan-2-yl-2,3,4,5-tetrahydro-1H-indene
CID 144533916
(3S)-3,4,4,6a-tetramethyl-2,3,3b,5,6,7-hexahydro-1H-cyclopenta[a]pentalene
CID 134831264
8-methyl-2,3,5,6,7,8-hexahydro-1H-azulen-4-one
CID 130028950
5-methyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one
CID 12612699
3-methylbicyclo[3.2.0]hept-1(5)-ene
CID 123354249
bis(2,3-dimethylcyclopenten-1-yl)-diethoxysilane
CID 23287453
(1R,4S,7R)-1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,4,5,6,7,8-octahydroazulene
CID 124524881

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene?
The IUPAC name of (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene (CID 149263121) is (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene.
What is the SMILES notation for (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene?
The canonical SMILES for (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene is C[C@@H]1CCC2=C1CC2.
What is the InChIKey of (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene?
The InChIKey is XPPWORVCYULDNT-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H12/c1-6-2-3-7-4-5-8(6)7/h6H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene?
(2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene has a molecular weight of 108.18 g/mol, XLogP of 2.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methylbicyclo[3.2.0]hept-1(5)-ene is sourced from PubChem (CID 149263121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).