1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene

C15H18 — CID 173271280

IUPAC1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene
SMILESCC1=CCC2=C1CC1=C(CC=C1C)CC2
InChIInChI=1S/C15H18/c1-10-3-5-12-7-8-13-6-4-11(2)15(13)9-14(10)12/h3-4H,5-9H2,1-2H3
InChIKeyHWLSYBZTSYIIAT-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.46
Rot. Bonds

About 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene

1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene (PubChem CID 173271280) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene.

Molecular Properties

Compound Name1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene
PubChem CID173271280
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene
SMILESCC1=CCC2=C1CC1=C(CC=C1C)CC2
InChIInChI=1S/C15H18/c1-10-3-5-12-7-8-13-6-4-11(2)15(13)9-14(10)12/h3-4H,5-9H2,1-2H3
InChIKeyHWLSYBZTSYIIAT-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene 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

ethane;3-methyl-4,5,6,7-tetrahydro-1H-indene
CID 142044962
3-methyl-1,5,6,7-tetrahydroinden-4-one
CID 142181977
(5Z)-2-methyl-5-(2-methylcyclopent-2-en-1-ylidene)cyclopent-2-en-1-one
CID 131236041
2,3-dimethylbicyclo[2.2.1]hepta-1,3-diene
CID 133065156
3,8-dimethyl-5-propan-2-yl-1,4-dihydroazulene
CID 171747830
2,3-dimethyl-6-propan-2-ylidenecyclohepta-1,3-diene
CID 86157820
3-trimethylsilyl-1,4,5,6,8,9-hexahydrobenzo[7]annulen-7-one
CID 73330305
1-[2-(2,3-dimethylcyclopenta-1,3-dien-1-yl)ethyl]-2,3-dimethylcyclopenta-1,3-diene
CID 21105891
tricyclo[6.2.0.03,6]deca-1(8),3(6)-diene
CID 2752902
(2,3-dimethylcyclopenta-1,3-dien-1-yl)-dimethylsilane
CID 123647541
6-methyl-1,3,4,8-tetrahydroquinoline-2,5-dione
CID 58784968
1,4-dimethylcyclohexa-1,4-diene
CID 4589179

Frequently Asked Questions

What is the IUPAC name of 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene?
The IUPAC name of 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene (CID 173271280) is 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene.
What is the SMILES notation for 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene?
The canonical SMILES for 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene is CC1=CCC2=C1CC1=C(CC=C1C)CC2.
What is the InChIKey of 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene?
The InChIKey is HWLSYBZTSYIIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-10-3-5-12-7-8-13-6-4-11(2)15(13)9-14(10)12/h3-4H,5-9H2,1-2H3.
What are the key properties of 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene?
1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene has a molecular weight of 198.31 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethyl-4,5,6,9-tetrahydro-3H-cyclopenta[f]azulene is sourced from PubChem (CID 173271280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).