3-phenylpyrrolo[1,2-a]benzimidazol-1-one

C16H10N2O — CID 23660962

IUPAC3-phenylpyrrolo[1,2-a]benzimidazol-1-one
SMILESO=C1C=C(c2ccccc2)c2nc3ccccc3n21
InChIInChI=1S/C16H10N2O/c19-15-10-12(11-6-2-1-3-7-11)16-17-13-8-4-5-9-14(13)18(15)16/h1-10H
InChIKeyNDXKSPKCESNUOZ-UHFFFAOYSA-N
MW246.27 g/mol
LogP3.12
Rot. Bonds1

About 3-phenylpyrrolo[1,2-a]benzimidazol-1-one

3-phenylpyrrolo[1,2-a]benzimidazol-1-one (PubChem CID 23660962) has the molecular formula C16H10N2O and a molecular weight of 246.27 g/mol. Its IUPAC name is 3-phenylpyrrolo[1,2-a]benzimidazol-1-one.

Molecular Properties

Compound Name3-phenylpyrrolo[1,2-a]benzimidazol-1-one
PubChem CID23660962
Molecular FormulaC16H10N2O
Molecular Weight246.27 g/mol
Exact Mass246.08
IUPAC Name3-phenylpyrrolo[1,2-a]benzimidazol-1-one
SMILESO=C1C=C(c2ccccc2)c2nc3ccccc3n21
InChIInChI=1S/C16H10N2O/c19-15-10-12(11-6-2-1-3-7-11)16-17-13-8-4-5-9-14(13)18(15)16/h1-10H
InChIKeyNDXKSPKCESNUOZ-UHFFFAOYSA-N
XLogP3.12
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-phenylpyrrolo[1,2-a]benzimidazol-1-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

1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287
1-(2-methylphenyl)-2-phenylbenzimidazole
CID 59359524
1-[4-bromo-2-(2-phenylbenzimidazol-1-yl)phenyl]-2-phenylbenzimidazole
CID 141480526
3-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazolin-4-one
CID 121247662
1-hydroxy-2-phenylbenzimidazole
CID 606555
[4-(2-phenylbenzimidazol-1-yl)phenyl]phosphane
CID 174737756
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-phenyl-1-pyridin-2-ylbenzimidazole
CID 134960173
2-(4-bromophenyl)-1-phenylbenzimidazole
CID 23094070
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497

Frequently Asked Questions

What is the IUPAC name of 3-phenylpyrrolo[1,2-a]benzimidazol-1-one?
The IUPAC name of 3-phenylpyrrolo[1,2-a]benzimidazol-1-one (CID 23660962) is 3-phenylpyrrolo[1,2-a]benzimidazol-1-one.
What is the SMILES notation for 3-phenylpyrrolo[1,2-a]benzimidazol-1-one?
The canonical SMILES for 3-phenylpyrrolo[1,2-a]benzimidazol-1-one is O=C1C=C(c2ccccc2)c2nc3ccccc3n21.
What is the InChIKey of 3-phenylpyrrolo[1,2-a]benzimidazol-1-one?
The InChIKey is NDXKSPKCESNUOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O/c19-15-10-12(11-6-2-1-3-7-11)16-17-13-8-4-5-9-14(13)18(15)16/h1-10H.
What are the key properties of 3-phenylpyrrolo[1,2-a]benzimidazol-1-one?
3-phenylpyrrolo[1,2-a]benzimidazol-1-one has a molecular weight of 246.27 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylpyrrolo[1,2-a]benzimidazol-1-one is sourced from PubChem (CID 23660962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).