N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide

C15H18N2O3S2 — CID 4573908

IUPACN-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)s1
InChIInChI=1S/C15H18N2O3S2/c1-10-5-7-12(9-14(10)22(19,20)17(3)4)16-15(18)13-8-6-11(2)21-13/h5-9H,1-4H3,(H,16,18)
InChIKeyOLFZOSMPKJDFCA-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.87
Rot. Bonds4

About N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide

N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide (PubChem CID 4573908) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide
PubChem CID4573908
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)s1
InChIInChI=1S/C15H18N2O3S2/c1-10-5-7-12(9-14(10)22(19,20)17(3)4)16-15(18)13-8-6-11(2)21-13/h5-9H,1-4H3,(H,16,18)
InChIKeyOLFZOSMPKJDFCA-UHFFFAOYSA-N
XLogP2.87
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)thiophene-2-carboxamide
CID 2292972
5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide
CID 1247495
2-methylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 2461859
N-[3-(methanesulfonamido)-4-methylphenyl]thiophene-3-carboxamide
CID 2811612
N-[5-(dimethylsulfamoyl)-2-methylphenyl]thiophene-2-carboxamide
CID 2811895
N-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
CID 2989171
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-5-nitrothiophene-2-carboxamide
CID 4791406
N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide
CID 4805705
4-{[Methyl(3-methylphenyl)amino]sulfonyl}thiophene-2-carboxamide
CID 6486034
6-Acetamido-2-sulfamoylbenzo[b]thiophene
CID 14390577
N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 730596
N-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiophene-2-carboxamide
CID 1012745

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide (CID 4573908) is N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)s1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide?
The InChIKey is OLFZOSMPKJDFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-10-5-7-12(9-14(10)22(19,20)17(3)4)16-15(18)13-8-6-11(2)21-13/h5-9H,1-4H3,(H,16,18).
What are the key properties of N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide?
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide has a molecular weight of 338.45 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 4573908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).