4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

C15H20N4O3S — CID 894979

IUPAC4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCc1nn(C)c(C)c1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C15H20N4O3S/c1-10-14(11(2)19(5)17-10)16-15(20)12-6-8-13(9-7-12)23(21,22)18(3)4/h6-9H,1-5H3,(H,16,20)
InChIKeySOVNTVIZRJLVLD-UHFFFAOYSA-N
MW336.42 g/mol
LogP1.54
Rot. Bonds4

About 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (PubChem CID 894979) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
PubChem CID894979
Molecular FormulaC15H20N4O3S
Molecular Weight336.42 g/mol
Exact Mass336.13
IUPAC Name4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCc1nn(C)c(C)c1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C15H20N4O3S/c1-10-14(11(2)19(5)17-10)16-15(20)12-6-8-13(9-7-12)23(21,22)18(3)4/h6-9H,1-5H3,(H,16,20)
InChIKeySOVNTVIZRJLVLD-UHFFFAOYSA-N
XLogP1.54
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (CID 894979) is 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is Cc1nn(C)c(C)c1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The InChIKey is SOVNTVIZRJLVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S/c1-10-14(11(2)19(5)17-10)16-15(20)12-6-8-13(9-7-12)23(21,22)18(3)4/h6-9H,1-5H3,(H,16,20).
What are the key properties of 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide has a molecular weight of 336.42 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is sourced from PubChem (CID 894979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).