3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide

C15H16N2O4S — CID 87026601

IUPAC3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(C(N)=O)c2)c(C)c1
InChIInChI=1S/C15H16N2O4S/c1-10-8-13(21-2)6-7-14(10)22(19,20)17-12-5-3-4-11(9-12)15(16)18/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyAOGZFBSTGODGCX-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.90
Rot. Bonds5

About 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide

3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide (PubChem CID 87026601) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide
PubChem CID87026601
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(C(N)=O)c2)c(C)c1
InChIInChI=1S/C15H16N2O4S/c1-10-8-13(21-2)6-7-14(10)22(19,20)17-12-5-3-4-11(9-12)15(16)18/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyAOGZFBSTGODGCX-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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Related Compounds

3-[(4-amino-2-methylphenyl)sulfonylamino]benzamide
CID 61107665
3-[(2-methylphenyl)sulfonylamino]benzamide
CID 63000187
[4-[(4-methoxy-2-methylphenyl)sulfonylamino]phenyl]urea
CID 47062796
N-(3-amino-4-methylphenyl)-4-methoxy-2-methylbenzenesulfonamide
CID 39439925
N-(3-acetylphenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112999558
4-methoxy-N-(4-methoxy-3-methylphenyl)-2-methylbenzenesulfonamide
CID 110776438
4-methoxy-2-methyl-N-quinoxalin-6-ylbenzenesulfonamide
CID 110723752
4-methoxy-2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 47062849
3-[2-[3-[(2,5-dimethoxyphenyl)sulfonylamino]phenyl]ethyl]benzoic acid;3-[2-[3-[(2,4-dimethylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 157484364
2,4-dimethoxy-N-(3-methylphenyl)benzenesulfonamide
CID 22773637
3-[(2-amino-4-fluorophenyl)sulfonylamino]benzamide
CID 61105800
N-(3-acetylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide
CID 95969889

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide (CID 87026601) is 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide is COc1ccc(S(=O)(=O)Nc2cccc(C(N)=O)c2)c(C)c1.
What is the InChIKey of 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide?
The InChIKey is AOGZFBSTGODGCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-10-8-13(21-2)6-7-14(10)22(19,20)17-12-5-3-4-11(9-12)15(16)18/h3-9,17H,1-2H3,(H2,16,18).
What are the key properties of 3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide?
3-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide 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-[(4-methoxy-2-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 87026601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).