6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane

C20H32 — CID 175675689

IUPAC6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
SMILESC=C1CCC2(C(C)C)CC12.C=C1CCC2CC1C2(C)C
InChIInChI=1S/2C10H16/c1-7-4-5-8-6-9(7)10(8,2)3;1-7(2)10-5-4-8(3)9(10)6-10/h8-9H,1,4-6H2,2-3H3;7,9H,3-6H2,1-2H3
InChIKeyRXPMTKOPXFPTER-UHFFFAOYSA-N
MW272.48 g/mol
LogP6.00
Rot. Bonds1

About 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane

6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane (PubChem CID 175675689) has the molecular formula C20H32 and a molecular weight of 272.48 g/mol. Its IUPAC name is 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane.

Molecular Properties

Compound Name6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
PubChem CID175675689
Molecular FormulaC20H32
Molecular Weight272.48 g/mol
Exact Mass272.25
IUPAC Name6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
SMILESC=C1CCC2(C(C)C)CC12.C=C1CCC2CC1C2(C)C
InChIInChI=1S/2C10H16/c1-7-4-5-8-6-9(7)10(8,2)3;1-7(2)10-5-4-8(3)9(10)6-10/h8-9H,1,4-6H2,2-3H3;7,9H,3-6H2,1-2H3
InChIKeyRXPMTKOPXFPTER-UHFFFAOYSA-N
XLogP6.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.48
LogP ≤ 56.00
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

2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
CID 173099126
(1R,5R)-2-(dideuterio(113C)methylidene)-6,6-dimethylbicyclo[3.1.1]heptane
CID 169445693
(5S)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;ethane;2-methylprop-2-enal
CID 144949863
(1S)-6,6-dimethylbicyclo[3.1.1]heptan-2-one
CID 58065052
(1S,5S)-1-[(2R)-6-methylhept-5-en-2-yl]-4-methylidenebicyclo[3.1.0]hexane
CID 91753589
(1R,3R,8S)-2,2,8-trimethyl-6-methylidenetricyclo[5.3.1.03,8]undecan-3-ol
CID 11053193
(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol
CID 24796073
(1R,5S)-7-methylidene-5-propan-2-ylbicyclo[3.2.0]heptan-2-one
CID 11480629
6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;1-methyl-4-propan-2-ylcyclohexane;4-methyl-1-propan-2-ylcyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene
CID 158508884
(E)-[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]heptanylidene]hydrazine
CID 90476379
(6,6-dimethyl-2-bicyclo[3.1.1]heptanylidene)methanone
CID 123486756
6a-methyl-4-methylidene-1,2,3,3a,5,6-hexahydropentalen-1-ol
CID 14262022

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane?
The IUPAC name of 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane (CID 175675689) is 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane.
What is the SMILES notation for 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane?
The canonical SMILES for 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane is C=C1CCC2(C(C)C)CC12.C=C1CCC2CC1C2(C)C.
What is the InChIKey of 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane?
The InChIKey is RXPMTKOPXFPTER-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H16/c1-7-4-5-8-6-9(7)10(8,2)3;1-7(2)10-5-4-8(3)9(10)6-10/h8-9H,1,4-6H2,2-3H3;7,9H,3-6H2,1-2H3.
What are the key properties of 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane?
6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane has a molecular weight of 272.48 g/mol, XLogP of 6.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane is sourced from PubChem (CID 175675689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).