4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide

C11H12N4O2S — CID 43616210

IUPAC4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide
SMILESCNc1ccc(S(=O)(=O)Nc2cnccn2)cc1
InChIInChI=1S/C11H12N4O2S/c1-12-9-2-4-10(5-3-9)18(16,17)15-11-8-13-6-7-14-11/h2-8,12H,1H3,(H,14,15)
InChIKeyGNAJXRSXBSBIKF-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.32
Rot. Bonds4

About 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide

4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide (PubChem CID 43616210) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide
PubChem CID43616210
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide
SMILESCNc1ccc(S(=O)(=O)Nc2cnccn2)cc1
InChIInChI=1S/C11H12N4O2S/c1-12-9-2-4-10(5-3-9)18(16,17)15-11-8-13-6-7-14-11/h2-8,12H,1H3,(H,14,15)
InChIKeyGNAJXRSXBSBIKF-UHFFFAOYSA-N
XLogP1.32
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The IUPAC name of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide (CID 43616210) is 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The canonical SMILES for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide is CNc1ccc(S(=O)(=O)Nc2cnccn2)cc1.
What is the InChIKey of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The InChIKey is GNAJXRSXBSBIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-12-9-2-4-10(5-3-9)18(16,17)15-11-8-13-6-7-14-11/h2-8,12H,1H3,(H,14,15).
What are the key properties of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide has a molecular weight of 264.31 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide is sourced from PubChem (CID 43616210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).