N-quinoxalin-6-ylbenzenesulfonamide

C14H11N3O2S — CID 3860445

IUPACN-quinoxalin-6-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccc2nccnc2c1)c1ccccc1
InChIInChI=1S/C14H11N3O2S/c18-20(19,12-4-2-1-3-5-12)17-11-6-7-13-14(10-11)16-9-8-15-13/h1-10,17H
InChIKeyRKCVNMHVXOGIAQ-UHFFFAOYSA-N
MW285.33 g/mol
LogP2.43
Rot. Bonds3

About N-quinoxalin-6-ylbenzenesulfonamide

N-quinoxalin-6-ylbenzenesulfonamide (PubChem CID 3860445) has the molecular formula C14H11N3O2S and a molecular weight of 285.33 g/mol. Its IUPAC name is N-quinoxalin-6-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-quinoxalin-6-ylbenzenesulfonamide
PubChem CID3860445
Molecular FormulaC14H11N3O2S
Molecular Weight285.33 g/mol
Exact Mass285.06
IUPAC NameN-quinoxalin-6-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccc2nccnc2c1)c1ccccc1
InChIInChI=1S/C14H11N3O2S/c18-20(19,12-4-2-1-3-5-12)17-11-6-7-13-14(10-11)16-9-8-15-13/h1-10,17H
InChIKeyRKCVNMHVXOGIAQ-UHFFFAOYSA-N
XLogP2.43
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-tert-butyl-4-pyridinyl)benzenesulfonamide
CID 110444579
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
N-(4-formyl-3-hydroxyphenyl)benzenesulfonamide
CID 819586
3-chloro-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
CID 11244517
2-methyl-N-quinoxalin-6-yl-1H-imidazole-5-sulfonamide
CID 63000218
4-fluoro-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
CID 110723750
N-[1-(2-phenylethynyl)benzimidazol-5-yl]benzenesulfonamide
CID 142781227
N-(2-propan-2-yl-1,3-benzoxazol-6-yl)benzenesulfonamide
CID 84562589
N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide
CID 2474403
4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
CID 110723752
5-bromo-3-methyl-N-quinoxalin-6-yltriazole-4-sulfonamide
CID 103354478
ethane;N-quinolin-3-ylbenzenesulfonamide
CID 90950237

Frequently Asked Questions

What is the IUPAC name of N-quinoxalin-6-ylbenzenesulfonamide?
The IUPAC name of N-quinoxalin-6-ylbenzenesulfonamide (CID 3860445) is N-quinoxalin-6-ylbenzenesulfonamide.
What is the SMILES notation for N-quinoxalin-6-ylbenzenesulfonamide?
The canonical SMILES for N-quinoxalin-6-ylbenzenesulfonamide is O=S(=O)(Nc1ccc2nccnc2c1)c1ccccc1.
What is the InChIKey of N-quinoxalin-6-ylbenzenesulfonamide?
The InChIKey is RKCVNMHVXOGIAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S/c18-20(19,12-4-2-1-3-5-12)17-11-6-7-13-14(10-11)16-9-8-15-13/h1-10,17H.
What are the key properties of N-quinoxalin-6-ylbenzenesulfonamide?
N-quinoxalin-6-ylbenzenesulfonamide has a molecular weight of 285.33 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinoxalin-6-ylbenzenesulfonamide is sourced from PubChem (CID 3860445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).