2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine

C24H19N7 — CID 137114172

IUPAC2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine
SMILESCc1ncc(-c2ccc3[nH]nc(-c4cc5c(-c6ccccn6)nccc5[nH]4)c3c2)n1C
InChIInChI=1S/C24H19N7/c1-14-27-13-22(31(14)2)15-6-7-19-16(11-15)24(30-29-19)21-12-17-18(28-21)8-10-26-23(17)20-5-3-4-9-25-20/h3-13,28H,1-2H3,(H,29,30)
InChIKeyXJNCSLVEBKKHIW-UHFFFAOYSA-N
MW405.47 g/mol
LogP4.88
Rot. Bonds3

About 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine

2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine (PubChem CID 137114172) has the molecular formula C24H19N7 and a molecular weight of 405.47 g/mol. Its IUPAC name is 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine
PubChem CID137114172
Molecular FormulaC24H19N7
Molecular Weight405.47 g/mol
Exact Mass405.17
IUPAC Name2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine
SMILESCc1ncc(-c2ccc3[nH]nc(-c4cc5c(-c6ccccn6)nccc5[nH]4)c3c2)n1C
InChIInChI=1S/C24H19N7/c1-14-27-13-22(31(14)2)15-6-7-19-16(11-15)24(30-29-19)21-12-17-18(28-21)8-10-26-23(17)20-5-3-4-9-25-20/h3-13,28H,1-2H3,(H,29,30)
InChIKeyXJNCSLVEBKKHIW-UHFFFAOYSA-N
XLogP4.88
TPSA88.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.47
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(furan-3-yl)-1H-pyrrolo[3,2-c]pyridine
CID 137088353
3-[2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-1H-pyrrolo[3,2-c]pyridin-4-yl]-5-fluorophenol
CID 137114058
5-(2,3-dimethylimidazol-4-yl)-3-[4-(2-fluorophenyl)-1H-indol-2-yl]-1H-indazole
CID 137115814
5-[3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137113766
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine
CID 137111808
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine
CID 137283181
N-propan-2-yl-5-[3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137114213
5-(2,3-dimethylimidazol-4-yl)-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137112372
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-(5-fluorothiophen-2-yl)-1H-pyrrolo[2,3-c]pyridine
CID 137087576
5-(1H-pyrazol-4-yl)-3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137111003
3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[3,4-c]pyridine
CID 137110457
N-[5-[3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]butanamide
CID 137312881

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine?
The IUPAC name of 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine (CID 137114172) is 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine?
The canonical SMILES for 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine is Cc1ncc(-c2ccc3[nH]nc(-c4cc5c(-c6ccccn6)nccc5[nH]4)c3c2)n1C.
What is the InChIKey of 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine?
The InChIKey is XJNCSLVEBKKHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N7/c1-14-27-13-22(31(14)2)15-6-7-19-16(11-15)24(30-29-19)21-12-17-18(28-21)8-10-26-23(17)20-5-3-4-9-25-20/h3-13,28H,1-2H3,(H,29,30).
What are the key properties of 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine?
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine has a molecular weight of 405.47 g/mol, XLogP of 4.88, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 137114172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).