N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide

C14H18N4O3S2 — CID 9074136

IUPACN-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2snnc2C)cc1
InChIInChI=1S/C14H18N4O3S2/c1-4-18(5-2)23(20,21)12-8-6-11(7-9-12)15-14(19)13-10(3)16-17-22-13/h6-9H,4-5H2,1-3H3,(H,15,19)
InChIKeyCWPQCJNFKCBWOR-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.13
Rot. Bonds6

About N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide

N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide (PubChem CID 9074136) has the molecular formula C14H18N4O3S2 and a molecular weight of 354.46 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide
PubChem CID9074136
Molecular FormulaC14H18N4O3S2
Molecular Weight354.46 g/mol
Exact Mass354.08
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2snnc2C)cc1
InChIInChI=1S/C14H18N4O3S2/c1-4-18(5-2)23(20,21)12-8-6-11(7-9-12)15-14(19)13-10(3)16-17-22-13/h6-9H,4-5H2,1-3H3,(H,15,19)
InChIKeyCWPQCJNFKCBWOR-UHFFFAOYSA-N
XLogP2.13
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-tert-butyl-N-[4-(diethylsulfamoyl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 48980775
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-4-methylthiadiazole-5-carboxamide
CID 7553108
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 9074206
N-[4-(diethylsulfamoyl)phenyl]-2,3-dimethylbenzamide
CID 9415963
N-(3-hydroxy-4-methylphenyl)-4-methylthiadiazole-5-carboxamide
CID 64792721
N-(3,4-dichlorophenyl)-4-methylthiadiazole-5-carboxamide
CID 7293435
4-[[4-(diethylsulfamoyl)benzoyl]amino]-N,N-dimethylbenzamide
CID 8698718
N-[4-(diethylsulfamoyl)phenyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 9415955
N-[4-(3-aminoprop-1-ynyl)phenyl]-4-methylthiadiazole-5-carboxamide
CID 60803056

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide (CID 9074136) is N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2snnc2C)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide?
The InChIKey is CWPQCJNFKCBWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3S2/c1-4-18(5-2)23(20,21)12-8-6-11(7-9-12)15-14(19)13-10(3)16-17-22-13/h6-9H,4-5H2,1-3H3,(H,15,19).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide?
N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide has a molecular weight of 354.46 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide is sourced from PubChem (CID 9074136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).