8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine

C12H15N7S — CID 80883484

IUPAC8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(Sc2nncn2C)n1
InChIInChI=1S/C12H15N7S/c1-3-4-13-9-7-19-6-5-14-10(19)11(16-9)20-12-17-15-8-18(12)2/h5-8,13H,3-4H2,1-2H3
InChIKeyAZZUHDJRPZHKTG-UHFFFAOYSA-N
MW289.37 g/mol
LogP1.83
Rot. Bonds5

About 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine

8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80883484) has the molecular formula C12H15N7S and a molecular weight of 289.37 g/mol. Its IUPAC name is 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80883484
Molecular FormulaC12H15N7S
Molecular Weight289.37 g/mol
Exact Mass289.11
IUPAC Name8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(Sc2nncn2C)n1
InChIInChI=1S/C12H15N7S/c1-3-4-13-9-7-19-6-5-14-10(19)11(16-9)20-12-17-15-8-18(12)2/h5-8,13H,3-4H2,1-2H3
InChIKeyAZZUHDJRPZHKTG-UHFFFAOYSA-N
XLogP1.83
TPSA72.93 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.37
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

8-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80888691
N-ethyl-8-(1-methylimidazol-2-yl)sulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80888111
8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80887812
8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80889678
N-ethyl-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80886756
5-methyl-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylpyrimidin-2-amine
CID 80882353
8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80854230
6-N,8-N,8-N-tripropylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80764672
2-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]sulfanylpyrimidine-4,6-diamine
CID 80882609
N-ethyl-8-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]imidazo[1,2-a]pyrazin-6-amine
CID 106928525
N-ethyl-8-propan-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80885373
8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80842087

Frequently Asked Questions

What is the IUPAC name of 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine (CID 80883484) is 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine is CCCNc1cn2ccnc2c(Sc2nncn2C)n1.
What is the InChIKey of 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is AZZUHDJRPZHKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N7S/c1-3-4-13-9-7-19-6-5-14-10(19)11(16-9)20-12-17-15-8-18(12)2/h5-8,13H,3-4H2,1-2H3.
What are the key properties of 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine?
8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 289.37 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80883484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).