N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide

C22H23N3O4S — CID 45110911

IUPACN-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccccn2)ccc1S(=O)(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C22H23N3O4S/c1-14-11-15(2)21(16(3)12-14)25-30(27,28)20-9-8-17(13-19(20)29-4)24-22(26)18-7-5-6-10-23-18/h5-13,25H,1-4H3,(H,24,26)
InChIKeyRLJVRGSVKOHEMY-UHFFFAOYSA-N
MW425.51 g/mol
LogP4.07
Rot. Bonds6

About N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide

N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide (PubChem CID 45110911) has the molecular formula C22H23N3O4S and a molecular weight of 425.51 g/mol. Its IUPAC name is N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
PubChem CID45110911
Molecular FormulaC22H23N3O4S
Molecular Weight425.51 g/mol
Exact Mass425.14
IUPAC NameN-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2ccccn2)ccc1S(=O)(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C22H23N3O4S/c1-14-11-15(2)21(16(3)12-14)25-30(27,28)20-9-8-17(13-19(20)29-4)24-22(26)18-7-5-6-10-23-18/h5-13,25H,1-4H3,(H,24,26)
InChIKeyRLJVRGSVKOHEMY-UHFFFAOYSA-N
XLogP4.07
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.51
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-methoxy-4-(phenylsulfamoyl)phenyl]pyridine-2-carboxamide
CID 45110912
2-methoxy-5-(pyridine-2-carbonylamino)benzenesulfonyl chloride
CID 43093324
2-methoxy-4-methyl-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 50876761
N-[3-methyl-4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]pyridine-2-carboxamide
CID 169307902
N-[3-[(2,6-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]-3-phenylpyridine-2-carboxamide
CID 168786153
N-(3-amino-4-methylphenyl)pyridine-2-carboxamide
CID 24707912
N-[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyphenyl]pyridine-2-carboxamide
CID 7908354
N-[4-[(2,4,6-trimethylphenyl)methylsulfamoyl]phenyl]pyridine-2-carboxamide
CID 45111504
N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 19224279
4-methoxy-2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 100710078
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide
CID 4811508
N-[3-[(2,6-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]quinoline-6-carboxamide
CID 156859982

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide (CID 45110911) is N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide is COc1cc(NC(=O)c2ccccn2)ccc1S(=O)(=O)Nc1c(C)cc(C)cc1C.
What is the InChIKey of N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The InChIKey is RLJVRGSVKOHEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4S/c1-14-11-15(2)21(16(3)12-14)25-30(27,28)20-9-8-17(13-19(20)29-4)24-22(26)18-7-5-6-10-23-18/h5-13,25H,1-4H3,(H,24,26).
What are the key properties of N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide?
N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide has a molecular weight of 425.51 g/mol, XLogP of 4.07, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 45110911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).