5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide

C16H14N4O3S2 — CID 26912608

IUPAC5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)s1
InChIInChI=1S/C16H14N4O3S2/c1-11-3-8-14(24-11)15(21)19-12-4-6-13(7-5-12)25(22,23)20-16-17-9-2-10-18-16/h2-10H,1H3,(H,19,21)(H,17,18,20)
InChIKeyFUVZXFUUMCVBGD-UHFFFAOYSA-N
MW374.45 g/mol
LogP2.90
Rot. Bonds5

About 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide

5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 26912608) has the molecular formula C16H14N4O3S2 and a molecular weight of 374.45 g/mol. Its IUPAC name is 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
PubChem CID26912608
Molecular FormulaC16H14N4O3S2
Molecular Weight374.45 g/mol
Exact Mass374.05
IUPAC Name5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)s1
InChIInChI=1S/C16H14N4O3S2/c1-11-3-8-14(24-11)15(21)19-12-4-6-13(7-5-12)25(22,23)20-16-17-9-2-10-18-16/h2-10H,1H3,(H,19,21)(H,17,18,20)
InChIKeyFUVZXFUUMCVBGD-UHFFFAOYSA-N
XLogP2.90
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.45
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3,5-dimethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 2597997
5-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 36865757
N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
CID 16608865
2,3,4,5,6-pentafluoro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 2169475
5-methyl-N-[2-[4-[(4-methylphenyl)sulfonylamino]anilino]-2-oxoethyl]thiophene-2-carboxamide
CID 55346126
4-(dimethylsulfamoyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 4671821
4-ethyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiadiazole-5-carboxamide
CID 18584570
N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 1164335
2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 700857
N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]furan-3-carboxamide
CID 674488
2-(4-methylphenyl)sulfonyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 6493238
3,4-dimethoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 1084470

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide (CID 26912608) is 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide is Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)s1.
What is the InChIKey of 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is FUVZXFUUMCVBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3S2/c1-11-3-8-14(24-11)15(21)19-12-4-6-13(7-5-12)25(22,23)20-16-17-9-2-10-18-16/h2-10H,1H3,(H,19,21)(H,17,18,20).
What are the key properties of 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide?
5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide has a molecular weight of 374.45 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 26912608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).