5-chloro-2-(methylamino)benzenesulfonamide

C7H9ClN2O2S — CID 44590431

IUPAC5-chloro-2-(methylamino)benzenesulfonamide
SMILESCNc1ccc(Cl)cc1S(N)(=O)=O
InChIInChI=1S/C7H9ClN2O2S/c1-10-6-3-2-5(8)4-7(6)13(9,11)12/h2-4,10H,1H3,(H2,9,11,12)
InChIKeyOLVBKPDAJZHAEV-UHFFFAOYSA-N
MW220.68 g/mol
LogP1.03
Rot. Bonds2

About 5-chloro-2-(methylamino)benzenesulfonamide

5-chloro-2-(methylamino)benzenesulfonamide (PubChem CID 44590431) has the molecular formula C7H9ClN2O2S and a molecular weight of 220.68 g/mol. Its IUPAC name is 5-chloro-2-(methylamino)benzenesulfonamide.

Molecular Properties

Compound Name5-chloro-2-(methylamino)benzenesulfonamide
PubChem CID44590431
Molecular FormulaC7H9ClN2O2S
Molecular Weight220.68 g/mol
Exact Mass220.01
IUPAC Name5-chloro-2-(methylamino)benzenesulfonamide
SMILESCNc1ccc(Cl)cc1S(N)(=O)=O
InChIInChI=1S/C7H9ClN2O2S/c1-10-6-3-2-5(8)4-7(6)13(9,11)12/h2-4,10H,1H3,(H2,9,11,12)
InChIKeyOLVBKPDAJZHAEV-UHFFFAOYSA-N
XLogP1.03
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.68
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(methylamino)benzenesulfonamide?
The IUPAC name of 5-chloro-2-(methylamino)benzenesulfonamide (CID 44590431) is 5-chloro-2-(methylamino)benzenesulfonamide.
What is the SMILES notation for 5-chloro-2-(methylamino)benzenesulfonamide?
The canonical SMILES for 5-chloro-2-(methylamino)benzenesulfonamide is CNc1ccc(Cl)cc1S(N)(=O)=O.
What is the InChIKey of 5-chloro-2-(methylamino)benzenesulfonamide?
The InChIKey is OLVBKPDAJZHAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O2S/c1-10-6-3-2-5(8)4-7(6)13(9,11)12/h2-4,10H,1H3,(H2,9,11,12).
What are the key properties of 5-chloro-2-(methylamino)benzenesulfonamide?
5-chloro-2-(methylamino)benzenesulfonamide has a molecular weight of 220.68 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(methylamino)benzenesulfonamide is sourced from PubChem (CID 44590431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).