(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene

C15H22 — CID 101349816

IUPAC(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene
SMILESC=C1CCC/C=C(/C)CCC2=C[C@H]1CC2
InChIInChI=1S/C15H22/c1-12-5-3-4-6-13(2)15-10-9-14(11-15)8-7-12/h5,11,15H,2-4,6-10H2,1H3/b12-5-/t15-/m1/s1
InChIKeyUTURGVPJEGEHFH-HYMFSAHRSA-N
MW202.34 g/mol
LogP4.79
Rot. Bonds

About (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene

(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene (PubChem CID 101349816) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene.

Molecular Properties

Compound Name(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene
PubChem CID101349816
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene
SMILESC=C1CCC/C=C(/C)CCC2=C[C@H]1CC2
InChIInChI=1S/C15H22/c1-12-5-3-4-6-13(2)15-10-9-14(11-15)8-7-12/h5,11,15H,2-4,6-10H2,1H3/b12-5-/t15-/m1/s1
InChIKeyUTURGVPJEGEHFH-HYMFSAHRSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene?
The IUPAC name of (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene (CID 101349816) is (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene.
What is the SMILES notation for (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene?
The canonical SMILES for (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene is C=C1CCC/C=C(/C)CCC2=C[C@H]1CC2.
What is the InChIKey of (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene?
The InChIKey is UTURGVPJEGEHFH-HYMFSAHRSA-N. The full InChI is InChI=1S/C15H22/c1-12-5-3-4-6-13(2)15-10-9-14(11-15)8-7-12/h5,11,15H,2-4,6-10H2,1H3/b12-5-/t15-/m1/s1.
What are the key properties of (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene?
(4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene has a molecular weight of 202.34 g/mol, XLogP of 4.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,10R)-4-methyl-9-methylidenebicyclo[8.2.1]trideca-1(13),4-diene is sourced from PubChem (CID 101349816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).