4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene

C15H22 — CID 74819450

IUPAC4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene
SMILESCC1=C2CC3CCC(C)C2(C=C1)C3(C)C
InChIInChI=1S/C15H22/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h7-8,11-12H,5-6,9H2,1-4H3
InChIKeyDPHLFUXQEZYZAP-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.34
Rot. Bonds

About 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene

4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene (PubChem CID 74819450) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene.

Molecular Properties

Compound Name4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene
PubChem CID74819450
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene
SMILESCC1=C2CC3CCC(C)C2(C=C1)C3(C)C
InChIInChI=1S/C15H22/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h7-8,11-12H,5-6,9H2,1-4H3
InChIKeyDPHLFUXQEZYZAP-UHFFFAOYSA-N
XLogP4.34
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 ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4,9,9-Tetramethyl-2,4,5,6,7,8-hexahydro-3H-3a,7-methanoazulene
CID 99856
(-)-Cyperene
CID 12308843
Cyprotene
CID 91715050
alpha-Cyperene
CID 91750213
Cypera-2,4(15)-diene
CID 91710045
Longifolene-(V4)
CID 570529
(1R,6R,9R)-4,9,11,11-tetramethyltricyclo[4.3.2.01,5]undec-4-ene
CID 21574489
Articulone
CID 131752013
D-Patchoulene
CID 131752045
Patchoula-2,4-diene
CID 42608161
(1R,7R,10R)-4,10-dimethyl-11-methylidenetricyclo[5.3.1.01,5]undec-4-ene
CID 102508391
7-Ethylidene-1,2,8,8-tetramethylbicyclo[3.2.1]octane
CID 85740510

Frequently Asked Questions

What is the IUPAC name of 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene?
The IUPAC name of 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene (CID 74819450) is 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene.
What is the SMILES notation for 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene?
The canonical SMILES for 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene is CC1=C2CC3CCC(C)C2(C=C1)C3(C)C.
What is the InChIKey of 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene?
The InChIKey is DPHLFUXQEZYZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h7-8,11-12H,5-6,9H2,1-4H3.
What are the key properties of 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene?
4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene has a molecular weight of 202.34 g/mol, XLogP of 4.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,10,11,11-tetramethyltricyclo[5.3.1.01,5]undeca-2,4-diene is sourced from PubChem (CID 74819450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).