3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene

C10H16 — CID 57043752

IUPAC3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene
SMILESCC(C)C1=C2CC2CC1C
InChIInChI=1S/C10H16/c1-6(2)10-7(3)4-8-5-9(8)10/h6-8H,4-5H2,1-3H3
InChIKeyAMGVZYNQCUKTBH-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.00
Rot. Bonds1

About 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene

3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene (PubChem CID 57043752) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene.

Molecular Properties

Compound Name3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene
PubChem CID57043752
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene
SMILESCC(C)C1=C2CC2CC1C
InChIInChI=1S/C10H16/c1-6(2)10-7(3)4-8-5-9(8)10/h6-8H,4-5H2,1-3H3
InChIKeyAMGVZYNQCUKTBH-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.00
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

Sesquithujene
CID 25147318
(1S,5S)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene
CID 53439065
7-Epi-sesquithujene
CID 56927990
(+)-(2S,6S,7S)-sesquithujene
CID 53359349
1-Menthene
CID 25445
2,3,4,5,6,7,8,9,10,11,12,13-Dodecahydro-2-methyl-1H-cyclopentacyclododecene
CID 14609946
(1R)-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]bicyclo[3.1.0]hex-2-ene
CID 53360556
1,2,3-Trimethylcyclohex-1-ene
CID 12537123
4-Methyl-3-carene
CID 14029516
Cyclopentene, 1,3-dimethyl-2-(1-methylethyl)-
CID 579282
1,3,3-Trimethyl-2-(2-methyl-cyclopropyl)-cyclohexene
CID 595941
1-(3-Methyl-cyclopent-2-enyl)-cyclohexene
CID 595506

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene?
The IUPAC name of 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene (CID 57043752) is 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene.
What is the SMILES notation for 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene?
The canonical SMILES for 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene is CC(C)C1=C2CC2CC1C.
What is the InChIKey of 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene?
The InChIKey is AMGVZYNQCUKTBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-6(2)10-7(3)4-8-5-9(8)10/h6-8H,4-5H2,1-3H3.
What are the key properties of 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene?
3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene has a molecular weight of 136.24 g/mol, XLogP of 3.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-propan-2-ylbicyclo[3.1.0]hex-1-ene is sourced from PubChem (CID 57043752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).