6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole

C22H18N4 — CID 159713009

IUPAC6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
SMILESCC1=Nc2ccc(-c3ccc4nc(-c5cncc(C)c5)[nH]c4c3)cc2C1
InChIInChI=1S/C22H18N4/c1-13-7-18(12-23-11-13)22-25-20-6-4-16(10-21(20)26-22)15-3-5-19-17(9-15)8-14(2)24-19/h3-7,9-12H,8H2,1-2H3,(H,25,26)
InChIKeyWLMRGPQCOCNRNU-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.25
Rot. Bonds2

About 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole

6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole (PubChem CID 159713009) has the molecular formula C22H18N4 and a molecular weight of 338.41 g/mol. Its IUPAC name is 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole.

Molecular Properties

Compound Name6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
PubChem CID159713009
Molecular FormulaC22H18N4
Molecular Weight338.41 g/mol
Exact Mass338.15
IUPAC Name6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
SMILESCC1=Nc2ccc(-c3ccc4nc(-c5cncc(C)c5)[nH]c4c3)cc2C1
InChIInChI=1S/C22H18N4/c1-13-7-18(12-23-11-13)22-25-20-6-4-16(10-21(20)26-22)15-3-5-19-17(9-15)8-14(2)24-19/h3-7,9-12H,8H2,1-2H3,(H,25,26)
InChIKeyWLMRGPQCOCNRNU-UHFFFAOYSA-N
XLogP5.25
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-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

6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
CID 159713006
6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
CID 159713005
6-methyl-2-(5-methyl-2-pyridinyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
CID 159713001
6-methyl-2-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole
CID 20689909
6-methyl-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922101
6-methyl-2-[3-(2-methyl-3,7-dihydropyrrolo[3,2-f]benzimidazol-6-yl)-5-(6-methyl-3,7-dihydropyrrolo[3,2-f]benzimidazol-2-yl)phenyl]-1,5-dihydroimidazo[4,5-f]benzimidazole
CID 164950642
6-(2-methyl-1H-indol-6-yl)-2-(3-methylphenyl)-1H-benzimidazole
CID 18683779
4,6-dimethyl-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
CID 82946962
methane;2-[4-[5-(2-methyl-3H-benzimidazol-5-yl)-1H-benzimidazol-2-yl]phenyl]-6-[2-(5-methyl-2-pyridinyl)-1H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(3-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(4-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-5-[2-(4-methylphenyl)-3H-indol-5-yl]-3H-indole;2-methyl-6-[2-(5-methylpyrazin-2-yl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(5-methyl-1H-pyrazol-3-yl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(5-methyl-2-pyridinyl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(5-methyl-3-pyridinyl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(6-methyl-2-pyridinyl)-3H-benzimidazol-5-yl]-1H-benzimidazole;2-methyl-6-[2-(6-methylpyrimidin-4-yl)-3H-benzimidazol-5-yl]-1H-benzimidazole;5-(2-propan-2-yl-3H-indol-5-yl)-2-[3-[5-[2-(4-propan-2-ylphenyl)-1H-benzimidazol-5-yl]-3H-indol-2-yl]phenyl]-1H-benzimidazole;2-propan-2-yl-5-[6-(2-propan-2-yl-3H-indol-5-yl)-1H-benzimidazol-2-yl]benzene-1,4-diol;sulfur trioxide
CID 163638485
2-(5-fluoro-3-pyridinyl)-6-(trifluoromethyl)-1H-benzimidazole
CID 104786107
6-chloro-2-(5-fluoro-3-pyridinyl)-1H-benzimidazole
CID 104786095
ethane;bis(2-methyl-6-[2-(3-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole);bis(2-methyl-6-[2-(4-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole)
CID 158043672

Frequently Asked Questions

What is the IUPAC name of 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole?
The IUPAC name of 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole (CID 159713009) is 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole.
What is the SMILES notation for 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole?
The canonical SMILES for 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole is CC1=Nc2ccc(-c3ccc4nc(-c5cncc(C)c5)[nH]c4c3)cc2C1.
What is the InChIKey of 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole?
The InChIKey is WLMRGPQCOCNRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4/c1-13-7-18(12-23-11-13)22-25-20-6-4-16(10-21(20)26-22)15-3-5-19-17(9-15)8-14(2)24-19/h3-7,9-12H,8H2,1-2H3,(H,25,26).
What are the key properties of 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole?
6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole has a molecular weight of 338.41 g/mol, XLogP of 5.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole is sourced from PubChem (CID 159713009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).