3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide

C15H16N2O4S — CID 86983204

IUPAC3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
SMILESCOc1ccccc1S(=O)(=O)Nc1cccc(C(N)=O)c1C
InChIInChI=1S/C15H16N2O4S/c1-10-11(15(16)18)6-5-7-12(10)17-22(19,20)14-9-4-3-8-13(14)21-2/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyAMUPZAKZYUDMDP-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.90
Rot. Bonds5

About 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide

3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide (PubChem CID 86983204) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
PubChem CID86983204
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
SMILESCOc1ccccc1S(=O)(=O)Nc1cccc(C(N)=O)c1C
InChIInChI=1S/C15H16N2O4S/c1-10-11(15(16)18)6-5-7-12(10)17-22(19,20)14-9-4-3-8-13(14)21-2/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyAMUPZAKZYUDMDP-UHFFFAOYSA-N
XLogP1.90
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide?
The IUPAC name of 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide (CID 86983204) is 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide.
What is the SMILES notation for 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide?
The canonical SMILES for 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide is COc1ccccc1S(=O)(=O)Nc1cccc(C(N)=O)c1C.
What is the InChIKey of 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide?
The InChIKey is AMUPZAKZYUDMDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-10-11(15(16)18)6-5-7-12(10)17-22(19,20)14-9-4-3-8-13(14)21-2/h3-9,17H,1-2H3,(H2,16,18).
What are the key properties of 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide?
3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide has a molecular weight of 320.37 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide is sourced from PubChem (CID 86983204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).