3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide

C17H20N2O5S — CID 39764163

IUPAC3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide
SMILESCOc1cc(C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc(OC)c1C
InChIInChI=1S/C17H20N2O5S/c1-10-5-6-13(9-16(10)25(18,21)22)19-17(20)12-7-14(23-3)11(2)15(8-12)24-4/h5-9H,1-4H3,(H,19,20)(H2,18,21,22)
InChIKeyHRULQZUOLRIGSV-UHFFFAOYSA-N
MW364.42 g/mol
LogP2.22
Rot. Bonds5

About 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide

3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide (PubChem CID 39764163) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide
PubChem CID39764163
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Name3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide
SMILESCOc1cc(C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc(OC)c1C
InChIInChI=1S/C17H20N2O5S/c1-10-5-6-13(9-16(10)25(18,21)22)19-17(20)12-7-14(23-3)11(2)15(8-12)24-4/h5-9H,1-4H3,(H,19,20)(H2,18,21,22)
InChIKeyHRULQZUOLRIGSV-UHFFFAOYSA-N
XLogP2.22
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-N-(4-methyl-3-sulfamoylphenyl)-4-propan-2-yloxybenzamide
CID 46520822
2-methoxy-5-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide
CID 9257170
3,5-dimethoxy-4-methyl-N-(3-sulfamoylphenyl)benzamide
CID 4241240
3,5-dichloro-N-(4-methoxy-3-sulfamoylphenyl)benzamide
CID 26929610
3,5-dimethoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 2092676
N-(3-methoxyphenyl)-3,4-dimethyl-5-sulfamoylbenzamide
CID 43022494
ethyl 4-[(3,5-dimethoxy-4-methylbenzoyl)amino]benzoate
CID 2677147
N-(4-methoxy-3-sulfamoylphenyl)pyridazine-4-carboxamide
CID 115742535
N-(4-methyl-3-sulfamoylphenyl)-3-propoxybenzamide
CID 87002439
4-(cyclopropanecarbonylamino)-N-(4-methyl-3-sulfamoylphenyl)benzamide
CID 46809533
N-(4-fluorophenyl)-4-methyl-3-sulfamoylbenzamide
CID 9070427
N-(4-cyanophenyl)-3,5-dimethoxy-4-methylbenzamide
CID 8009162

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide?
The IUPAC name of 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide (CID 39764163) is 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide.
What is the SMILES notation for 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide?
The canonical SMILES for 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide is COc1cc(C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc(OC)c1C.
What is the InChIKey of 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide?
The InChIKey is HRULQZUOLRIGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-10-5-6-13(9-16(10)25(18,21)22)19-17(20)12-7-14(23-3)11(2)15(8-12)24-4/h5-9H,1-4H3,(H,19,20)(H2,18,21,22).
What are the key properties of 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide?
3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide has a molecular weight of 364.42 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-4-methyl-N-(4-methyl-3-sulfamoylphenyl)benzamide is sourced from PubChem (CID 39764163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).