2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole

C22H17N5 — CID 166658665

IUPAC2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole
SMILESc1ccn2cc(-c3ccc4nc(-c5ccc6c(c5)NCC6)[nH]c4c3)nc2c1
InChIInChI=1S/C22H17N5/c1-2-10-27-13-20(24-21(27)3-1)15-6-7-17-19(11-15)26-22(25-17)16-5-4-14-8-9-23-18(14)12-16/h1-7,10-13,23H,8-9H2,(H,25,26)
InChIKeyDZCZLWKNVJNDFJ-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.51
Rot. Bonds2

About 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole

2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole (PubChem CID 166658665) has the molecular formula C22H17N5 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole
PubChem CID166658665
Molecular FormulaC22H17N5
Molecular Weight351.41 g/mol
Exact Mass351.15
IUPAC Name2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole
SMILESc1ccn2cc(-c3ccc4nc(-c5ccc6c(c5)NCC6)[nH]c4c3)nc2c1
InChIInChI=1S/C22H17N5/c1-2-10-27-13-20(24-21(27)3-1)15-6-7-17-19(11-15)26-22(25-17)16-5-4-14-8-9-23-18(14)12-16/h1-7,10-13,23H,8-9H2,(H,25,26)
InChIKeyDZCZLWKNVJNDFJ-UHFFFAOYSA-N
XLogP4.51
TPSA58.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyridin-4-yl-6-(2-pyridin-4-yl-3H-benzimidazol-5-yl)imidazo[1,2-a]pyridine
CID 54674924
2-(2,3-dihydro-1H-indol-5-yl)-6-fluoro-1H-benzimidazole
CID 60785781
6-[2-(3-phenylphenyl)-3H-benzimidazol-5-yl]imidazo[2,1-b][1,3]thiazole
CID 70864425
[5-[6-(1H-benzimidazol-2-yl)pyridine-2-carbonyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-(3-imidazo[1,2-a]pyridin-2-ylphenyl)methanone
CID 170038454
2-(1H-imidazol-2-yl)imidazo[1,2-a]pyridine
CID 122163818
2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine;hydroiodide
CID 45134937
2-[4-(4-methylphenyl)phenyl]imidazo[1,2-a]pyridine
CID 58880683
2-(1H-indol-6-yl)-6-(6-phenyl-1H-benzimidazol-2-yl)-1H-benzimidazole
CID 10048048
2-(1,2,3,4-tetrahydroquinolin-6-yl)-3H-benzimidazol-5-ol
CID 81429590
[6-(1H-benzimidazol-2-yl)-2-pyridinyl]-[1-(3-imidazo[1,2-a]pyridin-2-ylphenyl)piperidin-4-yl]methanone
CID 172852384
6-(1,3-dimethylpyrazol-4-yl)-2,3-dihydro-1H-indole
CID 116698588
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-pyrazin-2-yl-3H-benzimidazol-5-amine
CID 166372613

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole?
The IUPAC name of 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole (CID 166658665) is 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole is c1ccn2cc(-c3ccc4nc(-c5ccc6c(c5)NCC6)[nH]c4c3)nc2c1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole?
The InChIKey is DZCZLWKNVJNDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5/c1-2-10-27-13-20(24-21(27)3-1)15-6-7-17-19(11-15)26-22(25-17)16-5-4-14-8-9-23-18(14)12-16/h1-7,10-13,23H,8-9H2,(H,25,26).
What are the key properties of 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole?
2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole has a molecular weight of 351.41 g/mol, XLogP of 4.51, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-6-yl)-6-imidazo[1,2-a]pyridin-2-yl-1H-benzimidazole is sourced from PubChem (CID 166658665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).