N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide

C20H26N4O5S — CID 5043103

IUPACN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2ccc(=O)[nH]c2)c1
InChIInChI=1S/C20H26N4O5S/c1-3-24(4-2)30(27,28)16-6-7-18(23-9-11-29-12-10-23)17(13-16)22-20(26)15-5-8-19(25)21-14-15/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyXRONNTPRUDZRPB-UHFFFAOYSA-N
MW434.52 g/mol
LogP1.49
Rot. Bonds7

About N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide

N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 5043103) has the molecular formula C20H26N4O5S and a molecular weight of 434.52 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID5043103
Molecular FormulaC20H26N4O5S
Molecular Weight434.52 g/mol
Exact Mass434.16
IUPAC NameN-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2ccc(=O)[nH]c2)c1
InChIInChI=1S/C20H26N4O5S/c1-3-24(4-2)30(27,28)16-6-7-18(23-9-11-29-12-10-23)17(13-16)22-20(26)15-5-8-19(25)21-14-15/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyXRONNTPRUDZRPB-UHFFFAOYSA-N
XLogP1.49
TPSA111.81 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.52
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(Morpholin-4-yl)-5-(morpholine-4-sulfonyl)aniline
CID 3585374
(2S)-2-(benzenesulfonamido)-3-methyl-N-(2-morpholin-4-ylphenyl)butanamide
CID 2123914
N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
CID 4296426
1-[2-(Diethylamino)-5-morpholin-4-ylsulfonylphenyl]-3-phenylurea
CID 5075583
N-[2-(diethylamino)-5-morpholin-4-ylsulfonylphenyl]-2-[(6-oxo-4-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide
CID 135520961
N-[3-(diethylsulfamoyl)phenyl]-2-(3-morpholin-4-ylsulfonylanilino)acetamide
CID 24979096
3-amino-4-(cyclohexylamino)-N-(2-morpholin-4-ylethyl)benzenesulfonamide
CID 145955557
N-(4-Cyclohexylsulfamoyl-phenyl)-2-morpholin-4-yl-acetamide
CID 647448
N-(4-{[4-(4-morpholinylcarbonyl)-1-piperazinyl]sulfonyl}phenyl)acetamide
CID 1298827
(E)-3-[4-(diethylsulfamoyl)phenyl]-N-(2-morpholin-4-ylphenyl)prop-2-enamide
CID 2318822
N-(4-morpholin-4-ylsulfonylphenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 2529031
N-(4-{[4-(2-morpholino-2-oxoethyl)piperazino]sulfonyl}phenyl)acetamide
CID 2815598

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide (CID 5043103) is N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide is CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2ccc(=O)[nH]c2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is XRONNTPRUDZRPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O5S/c1-3-24(4-2)30(27,28)16-6-7-18(23-9-11-29-12-10-23)17(13-16)22-20(26)15-5-8-19(25)21-14-15/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,21,25)(H,22,26).
What are the key properties of N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 434.52 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 5043103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).