3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C13H15N3O3S2 — CID 2122705

IUPAC3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1
InChIInChI=1S/C13H15N3O3S2/c1-9-8-14-13(20-9)15-12(17)10-5-4-6-11(7-10)21(18,19)16(2)3/h4-8H,1-3H3,(H,14,15,17)
InChIKeySYUJZRGIVGHXLO-UHFFFAOYSA-N
MW325.42 g/mol
LogP1.95
Rot. Bonds4

About 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide

3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2122705) has the molecular formula C13H15N3O3S2 and a molecular weight of 325.42 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID2122705
Molecular FormulaC13H15N3O3S2
Molecular Weight325.42 g/mol
Exact Mass325.06
IUPAC Name3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1
InChIInChI=1S/C13H15N3O3S2/c1-9-8-14-13(20-9)15-12(17)10-5-4-6-11(7-10)21(18,19)16(2)3/h4-8H,1-3H3,(H,14,15,17)
InChIKeySYUJZRGIVGHXLO-UHFFFAOYSA-N
XLogP1.95
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)-2-(pyrrolidin-1-yl)benzamide
CID 2519269
N-2-Thiazolylbenzamide
CID 569547
4-Methyl-N-(1,3-thiazol-2-yl)benzamide
CID 576955
N-(5-phenyl-1,3-thiazol-2-yl)benzamide
CID 5329385
5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide
CID 8762613
4-[methyl(phenylsulfonyl)amino]-N-1,3-thiazol-2-ylbenzamide
CID 1309992
2-methyl-N-(5-methyl-2-thiazolyl)-1,1,4-trioxo-3H-1$l^{6},2-benzothiazine-3-carboxamide
CID 10291556
2-[3-Cyclopentyl-2-(4-methanesulfonyl-phenyl)-propionylamino]-thiazole-5-carboxylic acid amide
CID 23394566
(E)-4-methyl-2-(4-methylsulfonylphenyl)-N-(1,3-thiazol-2-yl)pent-2-enamide
CID 52943981
N-[5-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 73669508
N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 2673074
N-(5-bromo-1,3-thiazol-2-yl)benzamide
CID 16068636

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 2122705) is 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is SYUJZRGIVGHXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S2/c1-9-8-14-13(20-9)15-12(17)10-5-4-6-11(7-10)21(18,19)16(2)3/h4-8H,1-3H3,(H,14,15,17).
What are the key properties of 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 325.42 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2122705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).