tricyclo[6.3.0.01,5]undec-7-en-6-one

C11H14O — CID 13352001

IUPACtricyclo[6.3.0.01,5]undec-7-en-6-one
SMILESO=C1C=C2CCCC23CCCC13
InChIInChI=1S/C11H14O/c12-10-7-8-3-1-5-11(8)6-2-4-9(10)11/h7,9H,1-6H2
InChIKeyGYQPSGSXUNSBKE-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.47
Rot. Bonds

About tricyclo[6.3.0.01,5]undec-7-en-6-one

tricyclo[6.3.0.01,5]undec-7-en-6-one (PubChem CID 13352001) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is tricyclo[6.3.0.01,5]undec-7-en-6-one.

Molecular Properties

Compound Nametricyclo[6.3.0.01,5]undec-7-en-6-one
PubChem CID13352001
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Nametricyclo[6.3.0.01,5]undec-7-en-6-one
SMILESO=C1C=C2CCCC23CCCC13
InChIInChI=1S/C11H14O/c12-10-7-8-3-1-5-11(8)6-2-4-9(10)11/h7,9H,1-6H2
InChIKeyGYQPSGSXUNSBKE-UHFFFAOYSA-N
XLogP2.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze tricyclo[6.3.0.01,5]undec-7-en-6-one 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

2,2a,5,6,7,8-hexahydro-1H-cyclobuta[i]inden-3-one
CID 130029176
dimethyl 7-oxotricyclo[6.3.0.01,5]undec-5-ene-3,3-dicarboxylate
CID 102484614
tricyclo[6.4.1.01,5]tridec-5-ene-7,13-dione
CID 72760643
(1aR)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one
CID 171338423
(1aS,7R,7aR,7bR)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one
CID 21124439
spiro[3a,4,5,6,7,8-hexahydroazulene-3,1'-cyclopropane]-2-one
CID 102097571
8-methylspiro[3.4]octan-3-one
CID 557011
(3aS,7aS)-7a-methyl-6-(2-methylcyclopenten-1-yl)-2,3,3a,7-tetrahydro-1H-inden-4-one
CID 10955384
(10R)-10-methylspiro[4.5]decan-4-one
CID 130834325
5-hydroxy-4,4a-dimethyl-3,4,5,6,7,8-hexahydronaphthalen-2-one
CID 68964317
(4S,5S)-4-hydroxyspiro[4.7]dodecan-12-one
CID 15438101
(4R,5S)-4-hydroxyspiro[4.6]undecan-11-one
CID 130756206

Frequently Asked Questions

What is the IUPAC name of tricyclo[6.3.0.01,5]undec-7-en-6-one?
The IUPAC name of tricyclo[6.3.0.01,5]undec-7-en-6-one (CID 13352001) is tricyclo[6.3.0.01,5]undec-7-en-6-one.
What is the SMILES notation for tricyclo[6.3.0.01,5]undec-7-en-6-one?
The canonical SMILES for tricyclo[6.3.0.01,5]undec-7-en-6-one is O=C1C=C2CCCC23CCCC13.
What is the InChIKey of tricyclo[6.3.0.01,5]undec-7-en-6-one?
The InChIKey is GYQPSGSXUNSBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c12-10-7-8-3-1-5-11(8)6-2-4-9(10)11/h7,9H,1-6H2.
What are the key properties of tricyclo[6.3.0.01,5]undec-7-en-6-one?
tricyclo[6.3.0.01,5]undec-7-en-6-one has a molecular weight of 162.23 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[6.3.0.01,5]undec-7-en-6-one is sourced from PubChem (CID 13352001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).