pyrrolo[3,4-f]benzimidazole

C9H5N3 — CID 141277329

IUPACpyrrolo[3,4-f]benzimidazole
SMILESC1=NC=c2cc3c(cc21)=NC=N3
InChIInChI=1S/C9H5N3/c1-6-3-10-4-7(6)2-9-8(1)11-5-12-9/h1-5H
InChIKeyFBABNRDJZVJAGR-UHFFFAOYSA-N
MW155.16 g/mol
LogP0.15
Rot. Bonds

About pyrrolo[3,4-f]benzimidazole

pyrrolo[3,4-f]benzimidazole (PubChem CID 141277329) has the molecular formula C9H5N3 and a molecular weight of 155.16 g/mol. Its IUPAC name is pyrrolo[3,4-f]benzimidazole.

Molecular Properties

Compound Namepyrrolo[3,4-f]benzimidazole
PubChem CID141277329
Molecular FormulaC9H5N3
Molecular Weight155.16 g/mol
Exact Mass155.05
IUPAC Namepyrrolo[3,4-f]benzimidazole
SMILESC1=NC=c2cc3c(cc21)=NC=N3
InChIInChI=1S/C9H5N3/c1-6-3-10-4-7(6)2-9-8(1)11-5-12-9/h1-5H
InChIKeyFBABNRDJZVJAGR-UHFFFAOYSA-N
XLogP0.15
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 50.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze pyrrolo[3,4-f]benzimidazole 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

Imidazolo[4,5-f]indole
CID 18952429
Pyrrolo[2,3-f]indole
CID 21252022
Pyrrolo-[3,2-f]indole
CID 21252023
Pyrrolo[3,2-b]carbazole
CID 21886979
Pyrrolo[3,4 b]carbazole
CID 21887215
Imidazocarbazole
CID 21887508
Pyrrolo[3,4-a]carbazole
CID 21888113
Pyrrolobenzimidazole
CID 53687060
Pyrrolo[3,2-b]indole
CID 54405611
Azolo[1,4]benzodiazepine
CID 66714092
Pyrroloindole
CID 66734115
Pyrazolobenzimidazole
CID 67169610

Frequently Asked Questions

What is the IUPAC name of pyrrolo[3,4-f]benzimidazole?
The IUPAC name of pyrrolo[3,4-f]benzimidazole (CID 141277329) is pyrrolo[3,4-f]benzimidazole.
What is the SMILES notation for pyrrolo[3,4-f]benzimidazole?
The canonical SMILES for pyrrolo[3,4-f]benzimidazole is C1=NC=c2cc3c(cc21)=NC=N3.
What is the InChIKey of pyrrolo[3,4-f]benzimidazole?
The InChIKey is FBABNRDJZVJAGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5N3/c1-6-3-10-4-7(6)2-9-8(1)11-5-12-9/h1-5H.
What are the key properties of pyrrolo[3,4-f]benzimidazole?
pyrrolo[3,4-f]benzimidazole has a molecular weight of 155.16 g/mol, XLogP of 0.15, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolo[3,4-f]benzimidazole is sourced from PubChem (CID 141277329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).