2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide

C9H15N3O2S — CID 142353884

IUPAC2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide
SMILESCCc1cnc(C(C)CS(N)(=O)=O)cn1
InChIInChI=1S/C9H15N3O2S/c1-3-8-4-12-9(5-11-8)7(2)6-15(10,13)14/h4-5,7H,3,6H2,1-2H3,(H2,10,13,14)
InChIKeyHBCNMSUUTDBEIM-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.43
Rot. Bonds4

About 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide

2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide (PubChem CID 142353884) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide.

Molecular Properties

Compound Name2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide
PubChem CID142353884
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide
SMILESCCc1cnc(C(C)CS(N)(=O)=O)cn1
InChIInChI=1S/C9H15N3O2S/c1-3-8-4-12-9(5-11-8)7(2)6-15(10,13)14/h4-5,7H,3,6H2,1-2H3,(H2,10,13,14)
InChIKeyHBCNMSUUTDBEIM-UHFFFAOYSA-N
XLogP0.43
TPSA85.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide?
The IUPAC name of 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide (CID 142353884) is 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide.
What is the SMILES notation for 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide?
The canonical SMILES for 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide is CCc1cnc(C(C)CS(N)(=O)=O)cn1.
What is the InChIKey of 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide?
The InChIKey is HBCNMSUUTDBEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-3-8-4-12-9(5-11-8)7(2)6-15(10,13)14/h4-5,7H,3,6H2,1-2H3,(H2,10,13,14).
What are the key properties of 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide?
2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide has a molecular weight of 229.30 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylpyrazin-2-yl)propane-1-sulfonamide is sourced from PubChem (CID 142353884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).