3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole

C17H12N6 — CID 135409969

IUPAC3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole
SMILESc1c[nH]c(-c2n[nH]c3ccc(-c4cncc5[nH]ccc45)cc23)n1
InChIInChI=1S/C17H12N6/c1-2-14-12(16(23-22-14)17-20-5-6-21-17)7-10(1)13-8-18-9-15-11(13)3-4-19-15/h1-9,19H,(H,20,21)(H,22,23)
InChIKeyIBQYRKVUSAGLDG-UHFFFAOYSA-N
MW300.32 g/mol
LogP3.50
Rot. Bonds2

About 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole

3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole (PubChem CID 135409969) has the molecular formula C17H12N6 and a molecular weight of 300.32 g/mol. Its IUPAC name is 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole.

Molecular Properties

Compound Name3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole
PubChem CID135409969
Molecular FormulaC17H12N6
Molecular Weight300.32 g/mol
Exact Mass300.11
IUPAC Name3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole
SMILESc1c[nH]c(-c2n[nH]c3ccc(-c4cncc5[nH]ccc45)cc23)n1
InChIInChI=1S/C17H12N6/c1-2-14-12(16(23-22-14)17-20-5-6-21-17)7-10(1)13-8-18-9-15-11(13)3-4-19-15/h1-9,19H,(H,20,21)(H,22,23)
InChIKeyIBQYRKVUSAGLDG-UHFFFAOYSA-N
XLogP3.50
TPSA86.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 53.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1,3-benzoxazole
CID 171099892
4-pyridin-3-yl-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-pyrrolo[2,3-c]pyridine
CID 137116773
4-methyl-5-[3-(5-phenyl-1H-imidazol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 135992344
7-(4-fluorophenyl)-2-[5-(4-methyl-3-pyridinyl)-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridine
CID 136643021
7-pyridin-4-yl-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridine
CID 136937796
4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-N-benzylisoquinolin-8-amine
CID 135453498
2-(5-pyridin-4-yl-1H-indazol-3-yl)-4-thiophen-3-yl-1H-pyrrolo[2,3-c]pyridine
CID 137116471
3-(4-fluorophenyl)-5-pyrimidin-4-yl-1H-indazole
CID 90732532
3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-5-pyrimidin-5-yl-1H-indazole
CID 137087926
2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine
CID 137116367
5-[3-(4-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137116967
7-(5-methylthiophen-2-yl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-3H-imidazo[4,5-c]pyridine
CID 136600735

Frequently Asked Questions

What is the IUPAC name of 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole?
The IUPAC name of 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole (CID 135409969) is 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole.
What is the SMILES notation for 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole?
The canonical SMILES for 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole is c1c[nH]c(-c2n[nH]c3ccc(-c4cncc5[nH]ccc45)cc23)n1.
What is the InChIKey of 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole?
The InChIKey is IBQYRKVUSAGLDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N6/c1-2-14-12(16(23-22-14)17-20-5-6-21-17)7-10(1)13-8-18-9-15-11(13)3-4-19-15/h1-9,19H,(H,20,21)(H,22,23).
What are the key properties of 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole?
3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole has a molecular weight of 300.32 g/mol, XLogP of 3.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-imidazol-2-yl)-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole is sourced from PubChem (CID 135409969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).