2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide

C11H18N4O3S — CID 103931001

IUPAC2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide
SMILESCCNS(=O)(=O)CCNc1nccn(C2CC2)c1=O
InChIInChI=1S/C11H18N4O3S/c1-2-14-19(17,18)8-6-13-10-11(16)15(7-5-12-10)9-3-4-9/h5,7,9,14H,2-4,6,8H2,1H3,(H,12,13)
InChIKeySGFMGGBGSOSODK-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.07
Rot. Bonds7

About 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide

2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide (PubChem CID 103931001) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide.

Molecular Properties

Compound Name2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide
PubChem CID103931001
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide
SMILESCCNS(=O)(=O)CCNc1nccn(C2CC2)c1=O
InChIInChI=1S/C11H18N4O3S/c1-2-14-19(17,18)8-6-13-10-11(16)15(7-5-12-10)9-3-4-9/h5,7,9,14H,2-4,6,8H2,1H3,(H,12,13)
InChIKeySGFMGGBGSOSODK-UHFFFAOYSA-N
XLogP-0.07
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide?
The IUPAC name of 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide (CID 103931001) is 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide.
What is the SMILES notation for 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide?
The canonical SMILES for 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide is CCNS(=O)(=O)CCNc1nccn(C2CC2)c1=O.
What is the InChIKey of 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide?
The InChIKey is SGFMGGBGSOSODK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-2-14-19(17,18)8-6-13-10-11(16)15(7-5-12-10)9-3-4-9/h5,7,9,14H,2-4,6,8H2,1H3,(H,12,13).
What are the key properties of 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide?
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide has a molecular weight of 286.36 g/mol, XLogP of -0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N-ethylethanesulfonamide is sourced from PubChem (CID 103931001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).