8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C11H11BrN6O — CID 106418462

IUPAC8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1nc(CCNc2nc3c(Br)cccn3n2)no1
InChIInChI=1S/C11H11BrN6O/c1-7-14-9(17-19-7)4-5-13-11-15-10-8(12)3-2-6-18(10)16-11/h2-3,6H,4-5H2,1H3,(H,13,16)
InChIKeyRKEKZDBYUBCGIJ-UHFFFAOYSA-N
MW323.15 g/mol
LogP1.84
Rot. Bonds4

About 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 106418462) has the molecular formula C11H11BrN6O and a molecular weight of 323.15 g/mol. Its IUPAC name is 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID106418462
Molecular FormulaC11H11BrN6O
Molecular Weight323.15 g/mol
Exact Mass322.02
IUPAC Name8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1nc(CCNc2nc3c(Br)cccn3n2)no1
InChIInChI=1S/C11H11BrN6O/c1-7-14-9(17-19-7)4-5-13-11-15-10-8(12)3-2-6-18(10)16-11/h2-3,6H,4-5H2,1H3,(H,13,16)
InChIKeyRKEKZDBYUBCGIJ-UHFFFAOYSA-N
XLogP1.84
TPSA81.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.15
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

8-bromo-N-[2-(1-methylpyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 80688703
8-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114184520
2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-N-methylethanamine
CID 83844072
2-[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethylurea
CID 83112416
4-[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-1-methoxybutan-2-ol
CID 114163784
8-bromo-N-(2-phenylpropyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 104591764
8-bromo-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 115990428
2-bromo-6-[[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethylamino]methyl]phenol
CID 113229764
2-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2,3-diamine
CID 106413986
3-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]-2-methyloxolan-3-ol
CID 106102508
6-methyl-2-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2,5-diamine
CID 106413961
2-ethylsulfonyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]aniline
CID 102846338

Frequently Asked Questions

What is the IUPAC name of 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 106418462) is 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Cc1nc(CCNc2nc3c(Br)cccn3n2)no1.
What is the InChIKey of 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is RKEKZDBYUBCGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN6O/c1-7-14-9(17-19-7)4-5-13-11-15-10-8(12)3-2-6-18(10)16-11/h2-3,6H,4-5H2,1H3,(H,13,16).
What are the key properties of 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 323.15 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 106418462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).