4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide

C21H21N3O5S — CID 55855260

IUPAC4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)ccc1OC
InChIInChI=1S/C21H21N3O5S/c1-22-30(27,28)19-13-16(8-11-18(19)29-2)21(26)23-17-9-6-15(7-10-17)14-24-12-4-3-5-20(24)25/h3-13,22H,14H2,1-2H3,(H,23,26)
InChIKeyHNBDCLKZVRCCEL-UHFFFAOYSA-N
MW427.48 g/mol
LogP2.07
Rot. Bonds7

About 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide

4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide (PubChem CID 55855260) has the molecular formula C21H21N3O5S and a molecular weight of 427.48 g/mol. Its IUPAC name is 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide
PubChem CID55855260
Molecular FormulaC21H21N3O5S
Molecular Weight427.48 g/mol
Exact Mass427.12
IUPAC Name4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)ccc1OC
InChIInChI=1S/C21H21N3O5S/c1-22-30(27,28)19-13-16(8-11-18(19)29-2)21(26)23-17-9-6-15(7-10-17)14-24-12-4-3-5-20(24)25/h3-13,22H,14H2,1-2H3,(H,23,26)
InChIKeyHNBDCLKZVRCCEL-UHFFFAOYSA-N
XLogP2.07
TPSA106.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.48
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(dimethylsulfamoyl)-4-fluoro-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide
CID 55881988
4-methoxy-3-(methylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700507
4-methoxy-3-(methylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 40742205
N-(3-chloro-4-methylphenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
CID 40742199
5-chloro-4-iodo-2-methoxy-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide
CID 55881478
N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]-3-(prop-2-ynylsulfamoyl)benzamide
CID 55767178
N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
CID 40742194
5-(hydrazinecarbonyl)-2-methoxy-N-methylbenzenesulfonamide
CID 45373547
2-(3,4-dimethoxyphenyl)-4-methyl-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]-1,3-thiazole-5-carboxamide
CID 55855136
N-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]-4-methoxy-3-(methylsulfamoyl)benzamide
CID 56551947
N-[1-[(2-chlorophenyl)methyl]-6-oxo-3-pyridinyl]-3-(cyclopropylsulfamoyl)-4-methoxybenzamide
CID 46494532
methyl 4-[(2-oxo-1-pyridinyl)methyl]benzoate
CID 28833817

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide?
The IUPAC name of 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide (CID 55855260) is 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide.
What is the SMILES notation for 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide?
The canonical SMILES for 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide is CNS(=O)(=O)c1cc(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)ccc1OC.
What is the InChIKey of 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide?
The InChIKey is HNBDCLKZVRCCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O5S/c1-22-30(27,28)19-13-16(8-11-18(19)29-2)21(26)23-17-9-6-15(7-10-17)14-24-12-4-3-5-20(24)25/h3-13,22H,14H2,1-2H3,(H,23,26).
What are the key properties of 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide?
4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide has a molecular weight of 427.48 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-(methylsulfamoyl)-N-[4-[(2-oxo-1-pyridinyl)methyl]phenyl]benzamide is sourced from PubChem (CID 55855260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).