6-bromo-2-(6-methyl-2-pyridinyl)indazole

C13H10BrN3 — CID 118663766

IUPAC6-bromo-2-(6-methyl-2-pyridinyl)indazole
SMILESCc1cccc(-n2cc3ccc(Br)cc3n2)n1
InChIInChI=1S/C13H10BrN3/c1-9-3-2-4-13(15-9)17-8-10-5-6-11(14)7-12(10)16-17/h2-8H,1H3
InChIKeyVPYTVBIJNOMOTL-UHFFFAOYSA-N
MW288.15 g/mol
LogP3.49
Rot. Bonds1

About 6-bromo-2-(6-methyl-2-pyridinyl)indazole

6-bromo-2-(6-methyl-2-pyridinyl)indazole (PubChem CID 118663766) has the molecular formula C13H10BrN3 and a molecular weight of 288.15 g/mol. Its IUPAC name is 6-bromo-2-(6-methyl-2-pyridinyl)indazole.

Molecular Properties

Compound Name6-bromo-2-(6-methyl-2-pyridinyl)indazole
PubChem CID118663766
Molecular FormulaC13H10BrN3
Molecular Weight288.15 g/mol
Exact Mass287.01
IUPAC Name6-bromo-2-(6-methyl-2-pyridinyl)indazole
SMILESCc1cccc(-n2cc3ccc(Br)cc3n2)n1
InChIInChI=1S/C13H10BrN3/c1-9-3-2-4-13(15-9)17-8-10-5-6-11(14)7-12(10)16-17/h2-8H,1H3
InChIKeyVPYTVBIJNOMOTL-UHFFFAOYSA-N
XLogP3.49
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.15
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(6-methyl-2-pyridinyl)indazole?
The IUPAC name of 6-bromo-2-(6-methyl-2-pyridinyl)indazole (CID 118663766) is 6-bromo-2-(6-methyl-2-pyridinyl)indazole.
What is the SMILES notation for 6-bromo-2-(6-methyl-2-pyridinyl)indazole?
The canonical SMILES for 6-bromo-2-(6-methyl-2-pyridinyl)indazole is Cc1cccc(-n2cc3ccc(Br)cc3n2)n1.
What is the InChIKey of 6-bromo-2-(6-methyl-2-pyridinyl)indazole?
The InChIKey is VPYTVBIJNOMOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3/c1-9-3-2-4-13(15-9)17-8-10-5-6-11(14)7-12(10)16-17/h2-8H,1H3.
What are the key properties of 6-bromo-2-(6-methyl-2-pyridinyl)indazole?
6-bromo-2-(6-methyl-2-pyridinyl)indazole has a molecular weight of 288.15 g/mol, XLogP of 3.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(6-methyl-2-pyridinyl)indazole is sourced from PubChem (CID 118663766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).