2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine

C8H9N3O2S — CID 66972615

IUPAC2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine
SMILESCS(=O)(=O)Cc1cn2ccncc2n1
InChIInChI=1S/C8H9N3O2S/c1-14(12,13)6-7-5-11-3-2-9-4-8(11)10-7/h2-5H,6H2,1H3
InChIKeyRNDMMTUKYBRQIO-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.27
Rot. Bonds2

About 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine

2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine (PubChem CID 66972615) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine
PubChem CID66972615
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC Name2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine
SMILESCS(=O)(=O)Cc1cn2ccncc2n1
InChIInChI=1S/C8H9N3O2S/c1-14(12,13)6-7-5-11-3-2-9-4-8(11)10-7/h2-5H,6H2,1H3
InChIKeyRNDMMTUKYBRQIO-UHFFFAOYSA-N
XLogP0.27
TPSA64.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine (CID 66972615) is 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine is CS(=O)(=O)Cc1cn2ccncc2n1.
What is the InChIKey of 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine?
The InChIKey is RNDMMTUKYBRQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c1-14(12,13)6-7-5-11-3-2-9-4-8(11)10-7/h2-5H,6H2,1H3.
What are the key properties of 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine?
2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine has a molecular weight of 211.25 g/mol, XLogP of 0.27, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfonylmethyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 66972615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).