8-methylcyclopenta[a]inden-4-olate

C13H9O- — CID 134966336

IUPAC8-methylcyclopenta[a]inden-4-olate
SMILESCc1cccc2c1=C1C=CC=C1C=2[O-]
InChIInChI=1S/C13H10O/c1-8-4-2-7-11-12(8)9-5-3-6-10(9)13(11)14/h2-7,14H,1H3/p-1
InChIKeyLLMOZGJUAOYKIL-UHFFFAOYSA-M
MW181.21 g/mol
LogP0.12
Rot. Bonds

About 8-methylcyclopenta[a]inden-4-olate

8-methylcyclopenta[a]inden-4-olate (PubChem CID 134966336) has the molecular formula C13H9O- and a molecular weight of 181.21 g/mol. Its IUPAC name is 8-methylcyclopenta[a]inden-4-olate.

Molecular Properties

Compound Name8-methylcyclopenta[a]inden-4-olate
PubChem CID134966336
Molecular FormulaC13H9O-
Molecular Weight181.21 g/mol
Exact Mass181.07
IUPAC Name8-methylcyclopenta[a]inden-4-olate
SMILESCc1cccc2c1=C1C=CC=C1C=2[O-]
InChIInChI=1S/C13H10O/c1-8-4-2-7-11-12(8)9-5-3-6-10(9)13(11)14/h2-7,14H,1H3/p-1
InChIKeyLLMOZGJUAOYKIL-UHFFFAOYSA-M
XLogP0.12
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 8-methylcyclopenta[a]inden-4-olate 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

potassium 2,6-dimethylphenolate
CID 23686125
2,6-dimethyl-N-[(E)-prop-1-enyl]aniline;ethane
CID 142207467
1,2,3-trimethylpentalene
CID 166793534
benzene;1,2,3-trimethylbenzene
CID 159605245
ethane;1,2,3-trimethylbenzene
CID 54068667
potassium;1,2,3-trimethylbenzene;chloride
CID 174813799
(2,6-dimethylphenyl)oxidanium
CID 154084059
1,6-dimethyl-5-methylidenecyclohexa-1,3-diene;1,2,3-trimethylbenzene
CID 161461012
CID 102456770
CID 102456770
1,2,3,4-tetramethyl-2H-indol-1-ium
CID 87401853
1-N,2-N-bis(2,6-dimethylphenyl)-4,5-dimethoxybenzene-1,2-diamine
CID 86003268
N,N'-bis(2,6-dimethylphenyl)methanediamine
CID 21130207

Frequently Asked Questions

What is the IUPAC name of 8-methylcyclopenta[a]inden-4-olate?
The IUPAC name of 8-methylcyclopenta[a]inden-4-olate (CID 134966336) is 8-methylcyclopenta[a]inden-4-olate.
What is the SMILES notation for 8-methylcyclopenta[a]inden-4-olate?
The canonical SMILES for 8-methylcyclopenta[a]inden-4-olate is Cc1cccc2c1=C1C=CC=C1C=2[O-].
What is the InChIKey of 8-methylcyclopenta[a]inden-4-olate?
The InChIKey is LLMOZGJUAOYKIL-UHFFFAOYSA-M. The full InChI is InChI=1S/C13H10O/c1-8-4-2-7-11-12(8)9-5-3-6-10(9)13(11)14/h2-7,14H,1H3/p-1.
What are the key properties of 8-methylcyclopenta[a]inden-4-olate?
8-methylcyclopenta[a]inden-4-olate has a molecular weight of 181.21 g/mol, XLogP of 0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylcyclopenta[a]inden-4-olate is sourced from PubChem (CID 134966336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).