(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene

C15H24 — CID 154721252

IUPAC(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene
SMILESCC1=C[C@]2(C)CC[C@H]3[C@@H](C)CC[C@@]1(C)[C@@H]32
InChIInChI=1S/C15H24/c1-10-5-8-15(4)11(2)9-14(3)7-6-12(10)13(14)15/h9-10,12-13H,5-8H2,1-4H3/t10-,12-,13-,14-,15+/m0/s1
InChIKeyJJRXBSFZNXDSQY-MFGQWXODSA-N
MW204.36 g/mol
LogP4.41
Rot. Bonds

About (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene

(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene (PubChem CID 154721252) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene.

Molecular Properties

Compound Name(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene
PubChem CID154721252
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene
SMILESCC1=C[C@]2(C)CC[C@H]3[C@@H](C)CC[C@@]1(C)[C@@H]32
InChIInChI=1S/C15H24/c1-10-5-8-15(4)11(2)9-14(3)7-6-12(10)13(14)15/h9-10,12-13H,5-8H2,1-4H3/t10-,12-,13-,14-,15+/m0/s1
InChIKeyJJRXBSFZNXDSQY-MFGQWXODSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.41
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 (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene?
The IUPAC name of (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene (CID 154721252) is (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene.
What is the SMILES notation for (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene?
The canonical SMILES for (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene is CC1=C[C@]2(C)CC[C@H]3[C@@H](C)CC[C@@]1(C)[C@@H]32.
What is the InChIKey of (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene?
The InChIKey is JJRXBSFZNXDSQY-MFGQWXODSA-N. The full InChI is InChI=1S/C15H24/c1-10-5-8-15(4)11(2)9-14(3)7-6-12(10)13(14)15/h9-10,12-13H,5-8H2,1-4H3/t10-,12-,13-,14-,15+/m0/s1.
What are the key properties of (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene?
(1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene has a molecular weight of 204.36 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,4S,7S,8S,11S)-1,2,4,8-tetramethyltricyclo[5.3.1.04,11]undec-2-ene is sourced from PubChem (CID 154721252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).