5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

C20H26N4O4S — CID 46345791

IUPAC5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESCc1ccc(S(=O)(=O)N(C)c2cncc(C(=O)NCCN3CCOCC3)c2)cc1
InChIInChI=1S/C20H26N4O4S/c1-16-3-5-19(6-4-16)29(26,27)23(2)18-13-17(14-21-15-18)20(25)22-7-8-24-9-11-28-12-10-24/h3-6,13-15H,7-12H2,1-2H3,(H,22,25)
InChIKeyFNEFNMBFBWVZHR-UHFFFAOYSA-N
MW418.52 g/mol
LogP1.28
Rot. Bonds7

About 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (PubChem CID 46345791) has the molecular formula C20H26N4O4S and a molecular weight of 418.52 g/mol. Its IUPAC name is 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
PubChem CID46345791
Molecular FormulaC20H26N4O4S
Molecular Weight418.52 g/mol
Exact Mass418.17
IUPAC Name5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESCc1ccc(S(=O)(=O)N(C)c2cncc(C(=O)NCCN3CCOCC3)c2)cc1
InChIInChI=1S/C20H26N4O4S/c1-16-3-5-19(6-4-16)29(26,27)23(2)18-13-17(14-21-15-18)20(25)22-7-8-24-9-11-28-12-10-24/h3-6,13-15H,7-12H2,1-2H3,(H,22,25)
InChIKeyFNEFNMBFBWVZHR-UHFFFAOYSA-N
XLogP1.28
TPSA91.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.52
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methylbutyl)-5-[methyl-(4-methylphenyl)sulfonylamino]pyridine-3-carboxamide
CID 50795489
2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]-N-(2-morpholin-4-ylethyl)acetamide
CID 17247264
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229497
5-N-(3,4-dimethylphenyl)-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109104222
5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229512
3-[(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)benzamide
CID 4157842
5-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 117088063
N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 55660302
6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
CID 142825868
5-N-cyclopentyl-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109102673
N-(2-morpholin-4-ylethyl)-4-sulfamoylbenzamide
CID 25060315

Frequently Asked Questions

What is the IUPAC name of 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (CID 46345791) is 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is Cc1ccc(S(=O)(=O)N(C)c2cncc(C(=O)NCCN3CCOCC3)c2)cc1.
What is the InChIKey of 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The InChIKey is FNEFNMBFBWVZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4S/c1-16-3-5-19(6-4-16)29(26,27)23(2)18-13-17(14-21-15-18)20(25)22-7-8-24-9-11-28-12-10-24/h3-6,13-15H,7-12H2,1-2H3,(H,22,25).
What are the key properties of 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide has a molecular weight of 418.52 g/mol, XLogP of 1.28, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 46345791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).