6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole

C15H14BrN3 — CID 130231730

IUPAC6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole
SMILESCCc1cc(Br)cc2nn(-c3cccc(C)n3)cc12
InChIInChI=1S/C15H14BrN3/c1-3-11-7-12(16)8-14-13(11)9-19(18-14)15-6-4-5-10(2)17-15/h4-9H,3H2,1-2H3
InChIKeyBGKWMHZMPVPDTK-UHFFFAOYSA-N
MW316.20 g/mol
LogP4.05
Rot. Bonds2

About 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole

6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole (PubChem CID 130231730) has the molecular formula C15H14BrN3 and a molecular weight of 316.20 g/mol. Its IUPAC name is 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole.

Molecular Properties

Compound Name6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole
PubChem CID130231730
Molecular FormulaC15H14BrN3
Molecular Weight316.20 g/mol
Exact Mass315.04
IUPAC Name6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole
SMILESCCc1cc(Br)cc2nn(-c3cccc(C)n3)cc12
InChIInChI=1S/C15H14BrN3/c1-3-11-7-12(16)8-14-13(11)9-19(18-14)15-6-4-5-10(2)17-15/h4-9H,3H2,1-2H3
InChIKeyBGKWMHZMPVPDTK-UHFFFAOYSA-N
XLogP4.05
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.20
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole?
The IUPAC name of 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole (CID 130231730) is 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole.
What is the SMILES notation for 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole?
The canonical SMILES for 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole is CCc1cc(Br)cc2nn(-c3cccc(C)n3)cc12.
What is the InChIKey of 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole?
The InChIKey is BGKWMHZMPVPDTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3/c1-3-11-7-12(16)8-14-13(11)9-19(18-14)15-6-4-5-10(2)17-15/h4-9H,3H2,1-2H3.
What are the key properties of 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole?
6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole has a molecular weight of 316.20 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole is sourced from PubChem (CID 130231730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).