8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine

C13H12N4O3S — CID 80874626

IUPAC8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESCS(=O)(=O)c1cccc(Oc2nc(N)cn3ccnc23)c1
InChIInChI=1S/C13H12N4O3S/c1-21(18,19)10-4-2-3-9(7-10)20-13-12-15-5-6-17(12)8-11(14)16-13/h2-8H,14H2,1H3
InChIKeyFXBDEWLOYQKVOV-UHFFFAOYSA-N
MW304.33 g/mol
LogP1.51
Rot. Bonds3

About 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine

8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80874626) has the molecular formula C13H12N4O3S and a molecular weight of 304.33 g/mol. Its IUPAC name is 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80874626
Molecular FormulaC13H12N4O3S
Molecular Weight304.33 g/mol
Exact Mass304.06
IUPAC Name8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESCS(=O)(=O)c1cccc(Oc2nc(N)cn3ccnc23)c1
InChIInChI=1S/C13H12N4O3S/c1-21(18,19)10-4-2-3-9(7-10)20-13-12-15-5-6-17(12)8-11(14)16-13/h2-8H,14H2,1H3
InChIKeyFXBDEWLOYQKVOV-UHFFFAOYSA-N
XLogP1.51
TPSA99.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
CID 80872480
8-(4-chloro-3,5-dimethylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80874590
8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 82719370
8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80875674
[8-(3-methoxyphenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80915169
3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine
CID 102760799
8-(5-fluoro-2-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 102989110
8-(4-bromo-2-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80879807
8-(2-methyl-5-nitrophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80878888
3-(3-methylsulfonylphenoxy)pyrazine-2-carbonitrile
CID 60620396
5-amino-2-(3-methylsulfonylphenoxy)pyridine-3-carbonitrile
CID 60924024
(8-phenoxyimidazo[1,2-a]pyrazin-6-yl)hydrazine
CID 80915464

Frequently Asked Questions

What is the IUPAC name of 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine (CID 80874626) is 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine is CS(=O)(=O)c1cccc(Oc2nc(N)cn3ccnc23)c1.
What is the InChIKey of 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is FXBDEWLOYQKVOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O3S/c1-21(18,19)10-4-2-3-9(7-10)20-13-12-15-5-6-17(12)8-11(14)16-13/h2-8H,14H2,1H3.
What are the key properties of 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine?
8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 304.33 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80874626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).