4-chloro-2-methoxybenzenesulfonamide

C7H8ClNO3S — CID 43132238

IUPAC4-chloro-2-methoxybenzenesulfonamide
SMILESCOc1cc(Cl)ccc1S(N)(=O)=O
InChIInChI=1S/C7H8ClNO3S/c1-12-6-4-5(8)2-3-7(6)13(9,10)11/h2-4H,1H3,(H2,9,10,11)
InChIKeyZKVAHGNYNOAZDH-UHFFFAOYSA-N
MW221.66 g/mol
LogP1.00
Rot. Bonds2

About 4-chloro-2-methoxybenzenesulfonamide

4-chloro-2-methoxybenzenesulfonamide (PubChem CID 43132238) has the molecular formula C7H8ClNO3S and a molecular weight of 221.66 g/mol. Its IUPAC name is 4-chloro-2-methoxybenzenesulfonamide.

Molecular Properties

Compound Name4-chloro-2-methoxybenzenesulfonamide
PubChem CID43132238
Molecular FormulaC7H8ClNO3S
Molecular Weight221.66 g/mol
Exact Mass220.99
IUPAC Name4-chloro-2-methoxybenzenesulfonamide
SMILESCOc1cc(Cl)ccc1S(N)(=O)=O
InChIInChI=1S/C7H8ClNO3S/c1-12-6-4-5(8)2-3-7(6)13(9,10)11/h2-4H,1H3,(H2,9,10,11)
InChIKeyZKVAHGNYNOAZDH-UHFFFAOYSA-N
XLogP1.00
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.66
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methoxybenzenesulfonamide?
The IUPAC name of 4-chloro-2-methoxybenzenesulfonamide (CID 43132238) is 4-chloro-2-methoxybenzenesulfonamide.
What is the SMILES notation for 4-chloro-2-methoxybenzenesulfonamide?
The canonical SMILES for 4-chloro-2-methoxybenzenesulfonamide is COc1cc(Cl)ccc1S(N)(=O)=O.
What is the InChIKey of 4-chloro-2-methoxybenzenesulfonamide?
The InChIKey is ZKVAHGNYNOAZDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO3S/c1-12-6-4-5(8)2-3-7(6)13(9,10)11/h2-4H,1H3,(H2,9,10,11).
What are the key properties of 4-chloro-2-methoxybenzenesulfonamide?
4-chloro-2-methoxybenzenesulfonamide has a molecular weight of 221.66 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methoxybenzenesulfonamide is sourced from PubChem (CID 43132238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).