4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide

C20H19N3O4S — CID 2203728

IUPAC4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)NCc1cccnc1
InChIInChI=1S/C20H19N3O4S/c1-27-18-10-9-16(20(24)23-17-7-3-2-4-8-17)12-19(18)28(25,26)22-14-15-6-5-11-21-13-15/h2-13,22H,14H2,1H3,(H,23,24)
InChIKeyRUBVWCBMNBMYLR-UHFFFAOYSA-N
MW397.46 g/mol
LogP2.82
Rot. Bonds7

About 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide

4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide (PubChem CID 2203728) has the molecular formula C20H19N3O4S and a molecular weight of 397.46 g/mol. Its IUPAC name is 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound Name4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide
PubChem CID2203728
Molecular FormulaC20H19N3O4S
Molecular Weight397.46 g/mol
Exact Mass397.11
IUPAC Name4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)NCc1cccnc1
InChIInChI=1S/C20H19N3O4S/c1-27-18-10-9-16(20(24)23-17-7-3-2-4-8-17)12-19(18)28(25,26)22-14-15-6-5-11-21-13-15/h2-13,22H,14H2,1H3,(H,23,24)
InChIKeyRUBVWCBMNBMYLR-UHFFFAOYSA-N
XLogP2.82
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.46
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 47104151
3-(benzylsulfamoyl)-4-methoxybenzoic acid
CID 693909
4-methyl-N-(2-methylphenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 6462073
4-methoxy-3-(methylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700507
3-(benzylsulfamoyl)-4-chloro-N-(4-methoxyphenyl)benzamide
CID 24536240
N-phenyl-2-(pyridin-3-ylmethylamino)pyrimidine-5-carboxamide
CID 109258997
4-methoxy-3-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]sulfamoyl]benzoic acid
CID 24602714
4-methoxy-N-(2-methoxyethyl)-3-(pyridin-3-ylsulfamoyl)benzamide
CID 56684218
5-amino-2-methoxy-4-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 79961726
3-methoxy-N-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 100575412
5-chloro-2-methoxy-4-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 110757909
N-benzyl-2-methyl-5-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide
CID 35016747

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The IUPAC name of 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide (CID 2203728) is 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The canonical SMILES for 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide is COc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)NCc1cccnc1.
What is the InChIKey of 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The InChIKey is RUBVWCBMNBMYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4S/c1-27-18-10-9-16(20(24)23-17-7-3-2-4-8-17)12-19(18)28(25,26)22-14-15-6-5-11-21-13-15/h2-13,22H,14H2,1H3,(H,23,24).
What are the key properties of 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide has a molecular weight of 397.46 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 2203728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).