N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine

C11H11N5S2 — CID 80886588

IUPACN-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(Sc2nccs2)n1
InChIInChI=1S/C11H11N5S2/c1-2-12-8-7-16-5-3-13-9(16)10(15-8)18-11-14-4-6-17-11/h3-7,12H,2H2,1H3
InChIKeyPCKRXBMMWFGOLB-UHFFFAOYSA-N
MW277.38 g/mol
LogP2.77
Rot. Bonds4

About N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine

N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80886588) has the molecular formula C11H11N5S2 and a molecular weight of 277.38 g/mol. Its IUPAC name is N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound NameN-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80886588
Molecular FormulaC11H11N5S2
Molecular Weight277.38 g/mol
Exact Mass277.05
IUPAC NameN-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(Sc2nccs2)n1
InChIInChI=1S/C11H11N5S2/c1-2-12-8-7-16-5-3-13-9(16)10(15-8)18-11-14-4-6-17-11/h3-7,12H,2H2,1H3
InChIKeyPCKRXBMMWFGOLB-UHFFFAOYSA-N
XLogP2.77
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiazol_SC_A(3)', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80886756
N-ethyl-8-(1-methylimidazol-2-yl)sulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80888111
N-ethyl-8-propan-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80885373
2-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]sulfanylpyrimidine-4,6-diamine
CID 80882609
N-ethyl-8-pyrimidin-4-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80889297
methyl 2-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]sulfanylacetate
CID 80885709
N-ethyl-8-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]imidazo[1,2-a]pyrazin-6-amine
CID 106928525
8-butylsulfanyl-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80885141
N-ethyl-8-(2-methylpropylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 80893173
8-(2,5-dimethylphenyl)sulfanyl-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80872898
N-ethyl-8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 107765896
N-ethyl-8-(2-methoxyethylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 80884128

Frequently Asked Questions

What is the IUPAC name of N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine (CID 80886588) is N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine is CCNc1cn2ccnc2c(Sc2nccs2)n1.
What is the InChIKey of N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is PCKRXBMMWFGOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5S2/c1-2-12-8-7-16-5-3-13-9(16)10(15-8)18-11-14-4-6-17-11/h3-7,12H,2H2,1H3.
What are the key properties of N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 277.38 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80886588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).