N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine

C17H19N7 — CID 176503092

IUPACN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
SMILESCC(C)c1cc(NCCc2cn3ccccc3n2)c2nncn2n1
InChIInChI=1S/C17H19N7/c1-12(2)14-9-15(17-21-19-11-24(17)22-14)18-7-6-13-10-23-8-4-3-5-16(23)20-13/h3-5,8-12,18H,6-7H2,1-2H3
InChIKeyCXNREATUBINAOE-UHFFFAOYSA-N
MW321.39 g/mol
LogP2.55
Rot. Bonds5

About N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine (PubChem CID 176503092) has the molecular formula C17H19N7 and a molecular weight of 321.39 g/mol. Its IUPAC name is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine.

Molecular Properties

Compound NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
PubChem CID176503092
Molecular FormulaC17H19N7
Molecular Weight321.39 g/mol
Exact Mass321.17
IUPAC NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine
SMILESCC(C)c1cc(NCCc2cn3ccccc3n2)c2nncn2n1
InChIInChI=1S/C17H19N7/c1-12(2)14-9-15(17-21-19-11-24(17)22-14)18-7-6-13-10-23-8-4-3-5-16(23)20-13/h3-5,8-12,18H,6-7H2,1-2H3
InChIKeyCXNREATUBINAOE-UHFFFAOYSA-N
XLogP2.55
TPSA72.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.39
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4,6-dimethylpyrimidin-2-amine
CID 31537504
5-chloro-2-(2-imidazo[1,2-a]pyridin-2-ylethylamino)benzonitrile
CID 133285740
(1R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(4-methoxyphenyl)ethanamine
CID 97088460
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyridin-2-amine
CID 71871464
1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-[(2R)-2-morpholin-4-ylpropyl]urea
CID 94171449
4-(2-imidazo[1,2-a]pyridin-2-ylethylamino)-3-nitrobenzamide
CID 31257184
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-5-iodopyridin-2-amine
CID 166212596
3-[[(6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl)amino]methyl]benzonitrile
CID 176504914
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969414
1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methyl-3-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]guanidine;hydroiodide
CID 111585144
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methyl-8-nitroquinolin-4-amine
CID 133436471
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine (CID 176503092) is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine.
What is the SMILES notation for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The canonical SMILES for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine is CC(C)c1cc(NCCc2cn3ccccc3n2)c2nncn2n1.
What is the InChIKey of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
The InChIKey is CXNREATUBINAOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7/c1-12(2)14-9-15(17-21-19-11-24(17)22-14)18-7-6-13-10-23-8-4-3-5-16(23)20-13/h3-5,8-12,18H,6-7H2,1-2H3.
What are the key properties of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine?
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine has a molecular weight of 321.39 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-8-amine is sourced from PubChem (CID 176503092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).