6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene

C14H24 — CID 123163710

IUPAC6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene
SMILESCCC(C)C1=C2C(C)CCC12C(C)C
InChIInChI=1S/C14H24/c1-6-10(4)12-13-11(5)7-8-14(12,13)9(2)3/h9-11H,6-8H2,1-5H3
InChIKeyMEOLSCUHMGZNBN-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.41
Rot. Bonds3

About 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene

6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene (PubChem CID 123163710) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene.

Molecular Properties

Compound Name6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene
PubChem CID123163710
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene
SMILESCCC(C)C1=C2C(C)CCC12C(C)C
InChIInChI=1S/C14H24/c1-6-10(4)12-13-11(5)7-8-14(12,13)9(2)3/h9-11H,6-8H2,1-5H3
InChIKeyMEOLSCUHMGZNBN-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

beta-Patchoulene
CID 101731
Trichodiene
CID 114857
(1S-(1alpha,4alpha,7alpha))-1,2,3,4,5,6,7,8-Octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene
CID 12313993
Delta(6)-protoilludene
CID 15939655
Premnaspirodiene
CID 14355861
Sesquithujene
CID 25147318
alpha-Acoradiene
CID 90351
beta-Acoradiene
CID 20055537
(1S,5S)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene
CID 53439065
Bazzanene
CID 179421
Patchoulene
CID 91746471
(3S,5R,6R)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-ene
CID 90658578

Frequently Asked Questions

What is the IUPAC name of 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene?
The IUPAC name of 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene (CID 123163710) is 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene.
What is the SMILES notation for 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene?
The canonical SMILES for 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene is CCC(C)C1=C2C(C)CCC12C(C)C.
What is the InChIKey of 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene?
The InChIKey is MEOLSCUHMGZNBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-6-10(4)12-13-11(5)7-8-14(12,13)9(2)3/h9-11H,6-8H2,1-5H3.
What are the key properties of 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene?
6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene has a molecular weight of 192.35 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butan-2-yl-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-1(6)-ene is sourced from PubChem (CID 123163710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).