1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine

C10H13BrN4 — CID 116989892

IUPAC1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1nc2ccc(Br)cn2n1
InChIInChI=1S/C10H13BrN4/c1-10(2,12)5-8-13-9-4-3-7(11)6-15(9)14-8/h3-4,6H,5,12H2,1-2H3
InChIKeyXSLWWWPWBJRQSI-UHFFFAOYSA-N
MW269.15 g/mol
LogP1.77
Rot. Bonds2

About 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine

1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine (PubChem CID 116989892) has the molecular formula C10H13BrN4 and a molecular weight of 269.15 g/mol. Its IUPAC name is 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine
PubChem CID116989892
Molecular FormulaC10H13BrN4
Molecular Weight269.15 g/mol
Exact Mass268.03
IUPAC Name1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1nc2ccc(Br)cn2n1
InChIInChI=1S/C10H13BrN4/c1-10(2,12)5-8-13-9-4-3-7(11)6-15(9)14-8/h3-4,6H,5,12H2,1-2H3
InChIKeyXSLWWWPWBJRQSI-UHFFFAOYSA-N
XLogP1.77
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.15
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-2-(methylsulfanylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117257760
2-(azepan-1-ylmethyl)-6-bromo-[1,2,4]triazolo[1,5-a]pyridine
CID 117257708
1-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-methylpropan-2-amine
CID 22298779
6-bromo-2-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117130504
2-(2,2-dimethylpropyl)-6-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117130642
6-bromo-2-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117129831
3-[(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-2,3-dimethylbutan-2-ol
CID 114156336
2-[(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-N-tert-butylacetamide
CID 115356742
6-bromo-N-[(1-methylcyclopropyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 107143628
2-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-1-pyridin-3-ylethanone
CID 158107588
1-(5-bromopyrimidin-2-yl)-2-methylpropan-2-amine
CID 66764585
6-bromo-N-(1-ethylsulfanylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 113499143

Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine?
The IUPAC name of 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine (CID 116989892) is 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine.
What is the SMILES notation for 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine?
The canonical SMILES for 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine is CC(C)(N)Cc1nc2ccc(Br)cn2n1.
What is the InChIKey of 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine?
The InChIKey is XSLWWWPWBJRQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN4/c1-10(2,12)5-8-13-9-4-3-7(11)6-15(9)14-8/h3-4,6H,5,12H2,1-2H3.
What are the key properties of 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine?
1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine has a molecular weight of 269.15 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropan-2-amine is sourced from PubChem (CID 116989892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).