2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole

C17H17N3 — CID 81456351

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole
SMILESCc1cccc2nc(C3CNc4ccccc43)n(C)c12
InChIInChI=1S/C17H17N3/c1-11-6-5-9-15-16(11)20(2)17(19-15)13-10-18-14-8-4-3-7-12(13)14/h3-9,13,18H,10H2,1-2H3
InChIKeyCZVOZYWWZPAAAR-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.44
Rot. Bonds1

About 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole

2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole (PubChem CID 81456351) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole
PubChem CID81456351
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole
SMILESCc1cccc2nc(C3CNc4ccccc43)n(C)c12
InChIInChI=1S/C17H17N3/c1-11-6-5-9-15-16(11)20(2)17(19-15)13-10-18-14-8-4-3-7-12(13)14/h3-9,13,18H,10H2,1-2H3
InChIKeyCZVOZYWWZPAAAR-UHFFFAOYSA-N
XLogP3.44
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole (CID 81456351) is 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole is Cc1cccc2nc(C3CNc4ccccc43)n(C)c12.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole?
The InChIKey is CZVOZYWWZPAAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-11-6-5-9-15-16(11)20(2)17(19-15)13-10-18-14-8-4-3-7-12(13)14/h3-9,13,18H,10H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole?
2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole has a molecular weight of 263.34 g/mol, XLogP of 3.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-1,7-dimethylbenzimidazole is sourced from PubChem (CID 81456351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).