4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide

C17H20N4O4S — CID 55598355

IUPAC4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCc2ccnc(N3CCOCC3)c2)cc1
InChIInChI=1S/C17H20N4O4S/c18-17(22)14-1-3-15(4-2-14)26(23,24)20-12-13-5-6-19-16(11-13)21-7-9-25-10-8-21/h1-6,11,20H,7-10,12H2,(H2,18,22)
InChIKeyUBXBODDWTMYZNU-UHFFFAOYSA-N
MW376.44 g/mol
LogP0.50
Rot. Bonds6

About 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide

4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide (PubChem CID 55598355) has the molecular formula C17H20N4O4S and a molecular weight of 376.44 g/mol. Its IUPAC name is 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide
PubChem CID55598355
Molecular FormulaC17H20N4O4S
Molecular Weight376.44 g/mol
Exact Mass376.12
IUPAC Name4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCc2ccnc(N3CCOCC3)c2)cc1
InChIInChI=1S/C17H20N4O4S/c18-17(22)14-1-3-15(4-2-14)26(23,24)20-12-13-5-6-19-16(11-13)21-7-9-25-10-8-21/h1-6,11,20H,7-10,12H2,(H2,18,22)
InChIKeyUBXBODDWTMYZNU-UHFFFAOYSA-N
XLogP0.50
TPSA114.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-3-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propanamide
CID 32587077
4-[4-[(diethylsulfamoylamino)methyl]-2-pyridinyl]morpholine
CID 35402758
methyl 4-[(6-morpholin-4-yl-3-pyridinyl)methylsulfamoyl]benzoate
CID 25469683
4-bromo-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]benzenesulfonamide
CID 55913754
N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-4-phenylbenzenesulfonamide
CID 55873999
2-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32585275
3,4-difluoro-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]benzenesulfonamide
CID 36583572
(2S)-2-methylsulfonyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 94068233
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55587783
4-acetyl-N-[(4-morpholin-4-ylphenyl)methyl]benzenesulfonamide
CID 110405170
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
CID 32585359
6-chloro-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]pyridine-3-sulfonamide
CID 55874135

Frequently Asked Questions

What is the IUPAC name of 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide?
The IUPAC name of 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide (CID 55598355) is 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide.
What is the SMILES notation for 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide?
The canonical SMILES for 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)NCc2ccnc(N3CCOCC3)c2)cc1.
What is the InChIKey of 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide?
The InChIKey is UBXBODDWTMYZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O4S/c18-17(22)14-1-3-15(4-2-14)26(23,24)20-12-13-5-6-19-16(11-13)21-7-9-25-10-8-21/h1-6,11,20H,7-10,12H2,(H2,18,22).
What are the key properties of 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide?
4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide has a molecular weight of 376.44 g/mol, XLogP of 0.50, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-morpholin-4-yl-4-pyridinyl)methylsulfamoyl]benzamide is sourced from PubChem (CID 55598355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).