4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene

C14H20 — CID 145186062

IUPAC4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene
SMILESCC1CCC2C(C1)C1C3CC=CC3C21
InChIInChI=1S/C14H20/c1-8-5-6-11-12(7-8)14-10-4-2-3-9(10)13(11)14/h2-3,8-14H,4-7H2,1H3
InChIKeyVDSTVVXSHXDNRN-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.49
Rot. Bonds

About 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene

4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene (PubChem CID 145186062) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene.

Molecular Properties

Compound Name4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene
PubChem CID145186062
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene
SMILESCC1CCC2C(C1)C1C3CC=CC3C21
InChIInChI=1S/C14H20/c1-8-5-6-11-12(7-8)14-10-4-2-3-9(10)13(11)14/h2-3,8-14H,4-7H2,1H3
InChIKeyVDSTVVXSHXDNRN-UHFFFAOYSA-N
XLogP3.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.49
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

ethane;4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene
CID 145186061
8,9-dimethyltricyclo[5.2.1.02,6]dec-3-ene
CID 22949638
3,7,8-trimethylbicyclo[4.2.0]octane
CID 58950408
2,7,9,10-tetramethyl-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthrene
CID 90983654
ethane;pentacyclo[6.5.1.13,6.02,7.09,13]pentadec-10-ene
CID 91063776
(1S,2R,6R,7S)-tricyclo[5.2.1.02,6]dec-3-ene
CID 12592101
(1S,7R)-tricyclo[5.2.1.02,6]dec-3-ene
CID 11768627
(1R,2S,6R,7S)-tricyclo[5.2.1.02,6]dec-3-ene
CID 12592098
(1R,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-3-ene
CID 98044947
2-[(1R,5S,6S)-6-bicyclo[3.1.0]hex-2-enyl]-5,5-dimethyl-1,3-dioxane
CID 98200250
(3R)-1,3-dimethylcyclopentane
CID 13119651
1,3,6,8-tetramethylcyclodecane
CID 162455053

Frequently Asked Questions

What is the IUPAC name of 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene?
The IUPAC name of 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene (CID 145186062) is 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene.
What is the SMILES notation for 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene?
The canonical SMILES for 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene is CC1CCC2C(C1)C1C3CC=CC3C21.
What is the InChIKey of 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene?
The InChIKey is VDSTVVXSHXDNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-8-5-6-11-12(7-8)14-10-4-2-3-9(10)13(11)14/h2-3,8-14H,4-7H2,1H3.
What are the key properties of 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene?
4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene has a molecular weight of 188.31 g/mol, XLogP of 3.49, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyltetracyclo[6.5.0.02,7.09,13]tridec-10-ene is sourced from PubChem (CID 145186062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).