4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide

C24H26N4O5S — CID 166752447

IUPAC4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide
SMILESCOc1ncc(NC(=O)c2ccc(NC(C)=O)cc2C)cc1S(=O)(=O)Nc1c(C)cccc1C
InChIInChI=1S/C24H26N4O5S/c1-14-7-6-8-15(2)22(14)28-34(31,32)21-12-19(13-25-24(21)33-5)27-23(30)20-10-9-18(11-16(20)3)26-17(4)29/h6-13,28H,1-5H3,(H,26,29)(H,27,30)
InChIKeyUAKHXOPHBNJPDG-UHFFFAOYSA-N
MW482.56 g/mol
LogP4.03
Rot. Bonds7

About 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide

4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide (PubChem CID 166752447) has the molecular formula C24H26N4O5S and a molecular weight of 482.56 g/mol. Its IUPAC name is 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide.

Molecular Properties

Compound Name4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide
PubChem CID166752447
Molecular FormulaC24H26N4O5S
Molecular Weight482.56 g/mol
Exact Mass482.16
IUPAC Name4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide
SMILESCOc1ncc(NC(=O)c2ccc(NC(C)=O)cc2C)cc1S(=O)(=O)Nc1c(C)cccc1C
InChIInChI=1S/C24H26N4O5S/c1-14-7-6-8-15(2)22(14)28-34(31,32)21-12-19(13-25-24(21)33-5)27-23(30)20-10-9-18(11-16(20)3)26-17(4)29/h6-13,28H,1-5H3,(H,26,29)(H,27,30)
InChIKeyUAKHXOPHBNJPDG-UHFFFAOYSA-N
XLogP4.03
TPSA126.49 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.56
LogP ≤ 54.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-(difluoromethyl)-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-1-methylpyrazole-4-carboxamide
CID 166752375
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole-3-carboxamide
CID 166752353
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 166752364
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 166752240
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-1,5-dimethylpyrazole-3-carboxamide
CID 166752154
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-5-methoxy-1-methylpyrazole-3-carboxamide
CID 166752227
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 166752176
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 166752251
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-3-(trifluoromethyl)thiophene-2-carboxamide
CID 166752318
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-1-methylindazole-3-carboxamide
CID 166748195
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-phenyl-1,3-oxazole-4-carboxamide
CID 166748291
N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-3-carboxamide
CID 166748243

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide?
The IUPAC name of 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide (CID 166752447) is 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide.
What is the SMILES notation for 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide?
The canonical SMILES for 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide is COc1ncc(NC(=O)c2ccc(NC(C)=O)cc2C)cc1S(=O)(=O)Nc1c(C)cccc1C.
What is the InChIKey of 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide?
The InChIKey is UAKHXOPHBNJPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O5S/c1-14-7-6-8-15(2)22(14)28-34(31,32)21-12-19(13-25-24(21)33-5)27-23(30)20-10-9-18(11-16(20)3)26-17(4)29/h6-13,28H,1-5H3,(H,26,29)(H,27,30).
What are the key properties of 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide?
4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide has a molecular weight of 482.56 g/mol, XLogP of 4.03, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-methylbenzamide is sourced from PubChem (CID 166752447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).