(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene

C14H20 — CID 135026576

IUPAC(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene
SMILESC=C1C2CCC[C@]23C=C[C@@H](C3)C1(C)C
InChIInChI=1S/C14H20/c1-10-12-5-4-7-14(12)8-6-11(9-14)13(10,2)3/h6,8,11-12H,1,4-5,7,9H2,2-3H3/t11-,12?,14+/m0/s1
InChIKeyLSIAPMVSOORBPA-HFUMIRBISA-N
MW188.31 g/mol
LogP3.94
Rot. Bonds

About (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene

(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene (PubChem CID 135026576) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene.

Molecular Properties

Compound Name(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene
PubChem CID135026576
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene
SMILESC=C1C2CCC[C@]23C=C[C@@H](C3)C1(C)C
InChIInChI=1S/C14H20/c1-10-12-5-4-7-14(12)8-6-11(9-14)13(10,2)3/h6,8,11-12H,1,4-5,7,9H2,2-3H3/t11-,12?,14+/m0/s1
InChIKeyLSIAPMVSOORBPA-HFUMIRBISA-N
XLogP3.94
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 ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,2S,6S)-6-methylbicyclo[4.1.0]heptan-2-ol
CID 10931443
2,2,4-trimethyl-3-methylidenebicyclo[3.2.1]oct-6-ene
CID 12616171
(1R,2S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecan-2-ol
CID 91752695
(1R,4S)-1,3,3-trimethyl-2-methylidenebicyclo[2.2.1]heptane
CID 11435040
methanol;1,5,5-trimethylbicyclo[2.1.1]hex-2-ene
CID 67585053
7a-methyl-1-methylidene-3,3a,4,5,6,7-hexahydro-2H-inden-4-ol
CID 143095782
2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;methanol
CID 19065853
2-(4,4-dimethylcyclohex-2-en-1-yl)-1,3-dithian-2-ol
CID 577135
1-(2-methylcyclopentyl)bicyclo[2.2.1]hept-2-ene
CID 21426215
(6R)-3,6-dimethyl-6-[(1S)-1-methyl-2-methylidenecyclopentyl]cyclohexen-1-ol
CID 10727671
(1R,5S,8R)-6-methylidenespiro[11-oxatricyclo[6.2.1.01,5]undec-9-ene-7,1'-cyclohexane]
CID 15637566
(1S,2R,3R)-3-ethenyl-3-methylcyclohexane-1,2-diol
CID 155705531

Frequently Asked Questions

What is the IUPAC name of (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene?
The IUPAC name of (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene (CID 135026576) is (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene.
What is the SMILES notation for (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene?
The canonical SMILES for (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene is C=C1C2CCC[C@]23C=C[C@@H](C3)C1(C)C.
What is the InChIKey of (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene?
The InChIKey is LSIAPMVSOORBPA-HFUMIRBISA-N. The full InChI is InChI=1S/C14H20/c1-10-12-5-4-7-14(12)8-6-11(9-14)13(10,2)3/h6,8,11-12H,1,4-5,7,9H2,2-3H3/t11-,12?,14+/m0/s1.
What are the key properties of (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene?
(1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene has a molecular weight of 188.31 g/mol, XLogP of 3.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,8R)-7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undec-9-ene is sourced from PubChem (CID 135026576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).