6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine

C11H17N5O2S — CID 80791433

IUPAC6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NCCS(C)(=O)=O)n1
InChIInChI=1S/C11H17N5O2S/c1-3-12-9-8-16-6-4-14-11(16)10(15-9)13-5-7-19(2,17)18/h4,6,8,12H,3,5,7H2,1-2H3,(H,13,15)
InChIKeyCHVCSQBDOXOLGB-UHFFFAOYSA-N
MW283.36 g/mol
LogP0.62
Rot. Bonds6

About 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine

6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80791433) has the molecular formula C11H17N5O2S and a molecular weight of 283.36 g/mol. Its IUPAC name is 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80791433
Molecular FormulaC11H17N5O2S
Molecular Weight283.36 g/mol
Exact Mass283.11
IUPAC Name6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(NCCS(C)(=O)=O)n1
InChIInChI=1S/C11H17N5O2S/c1-3-12-9-8-16-6-4-14-11(16)10(15-9)13-5-7-19(2,17)18/h4,6,8,12H,3,5,7H2,1-2H3,(H,13,15)
InChIKeyCHVCSQBDOXOLGB-UHFFFAOYSA-N
XLogP0.62
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-N-ethyl-8-N-(2-methyl-2-methylsulfonylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80837011
6-N-ethyl-8-N-hexylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80835650
methyl 2-[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]acetate
CID 80777733
6-N-ethyl-8-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80840517
8-N-[2-[cyclopropyl(methyl)amino]ethyl]-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80823604
6-N-ethyl-8-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 106412064
6-N-ethyl-8-N-(2-methoxy-2-methylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 104767303
8-N-(1-methylsulfonylpropan-2-yl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80826533
8-N-(2-propan-2-yloxyethyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 104767136
N-[2-[[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]amino]ethyl]acetamide
CID 80788012
1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol
CID 80843105
N-butyl-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80931834

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80791433) is 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine is CCNc1cn2ccnc2c(NCCS(C)(=O)=O)n1.
What is the InChIKey of 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is CHVCSQBDOXOLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2S/c1-3-12-9-8-16-6-4-14-11(16)10(15-9)13-5-7-19(2,17)18/h4,6,8,12H,3,5,7H2,1-2H3,(H,13,15).
What are the key properties of 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 283.36 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-8-N-(2-methylsulfonylethyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80791433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).