6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine

C10H11Br2N3 — CID 129050183

IUPAC6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)(C)c1c(Br)cn2ncnc2c1Br
InChIInChI=1S/C10H11Br2N3/c1-10(2,3)7-6(11)4-15-9(8(7)12)13-5-14-15/h4-5H,1-3H3
InChIKeyHNPZOLJIVGZEGW-UHFFFAOYSA-N
MW333.03 g/mol
LogP3.55
Rot. Bonds

About 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine

6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 129050183) has the molecular formula C10H11Br2N3 and a molecular weight of 333.03 g/mol. Its IUPAC name is 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID129050183
Molecular FormulaC10H11Br2N3
Molecular Weight333.03 g/mol
Exact Mass330.93
IUPAC Name6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)(C)c1c(Br)cn2ncnc2c1Br
InChIInChI=1S/C10H11Br2N3/c1-10(2,3)7-6(11)4-15-9(8(7)12)13-5-14-15/h4-5H,1-3H3
InChIKeyHNPZOLJIVGZEGW-UHFFFAOYSA-N
XLogP3.55
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.03
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-tert-butyl-6-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 166563415
6-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine
CID 131677042
6-bromo-8-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyrazine
CID 158120099
7,8-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 164876385
6-chloro-8-methyl-[1,2,4]triazolo[1,5-a]pyrazine
CID 121232255
6-chloro-8-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 66636284
8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 164553586
8-bromo-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 173094110
7-methylidenepyrrolo[1,2-b][1,2,4]triazol-6-ol
CID 162937311
5-bromo-6-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 163376472
6-ethenyl-8-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 167620295
6-bromo-5-chloropyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 166982820

Frequently Asked Questions

What is the IUPAC name of 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine (CID 129050183) is 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine is CC(C)(C)c1c(Br)cn2ncnc2c1Br.
What is the InChIKey of 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is HNPZOLJIVGZEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Br2N3/c1-10(2,3)7-6(11)4-15-9(8(7)12)13-5-14-15/h4-5H,1-3H3.
What are the key properties of 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine?
6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 333.03 g/mol, XLogP of 3.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dibromo-7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 129050183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).