2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one

C7H8N2O — CID 82418615

IUPAC2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
SMILESCc1nc2c([nH]1)CCC2=O
InChIInChI=1S/C7H8N2O/c1-4-8-5-2-3-6(10)7(5)9-4/h2-3H2,1H3,(H,8,9)
InChIKeyVTKQDXSVXWYAAS-UHFFFAOYSA-N
MW136.15 g/mol
LogP0.85
Rot. Bonds

About 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one

2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one (PubChem CID 82418615) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol. Its IUPAC name is 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one.

Molecular Properties

Compound Name2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
PubChem CID82418615
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one
SMILESCc1nc2c([nH]1)CCC2=O
InChIInChI=1S/C7H8N2O/c1-4-8-5-2-3-6(10)7(5)9-4/h2-3H2,1H3,(H,8,9)
InChIKeyVTKQDXSVXWYAAS-UHFFFAOYSA-N
XLogP0.85
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-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

CID 13058849
CID 13058849
CID 12318782
CID 12318782
CID 12830384
CID 12830384
CID 30033301
CID 30033301
CID 134989914
CID 134989914
CID 146050307
CID 146050307
CID 343376
CID 343376
CID 10176362
CID 10176362
CID 11240959
CID 11240959
CID 13177012
CID 13177012
CID 13314354
CID 13314354
CID 13314355
CID 13314355

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The IUPAC name of 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one (CID 82418615) is 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one.
What is the SMILES notation for 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The canonical SMILES for 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one is Cc1nc2c([nH]1)CCC2=O.
What is the InChIKey of 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
The InChIKey is VTKQDXSVXWYAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O/c1-4-8-5-2-3-6(10)7(5)9-4/h2-3H2,1H3,(H,8,9).
What are the key properties of 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one?
2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one has a molecular weight of 136.15 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5,6-dihydro-1H-cyclopenta[d]imidazol-4-one is sourced from PubChem (CID 82418615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).