N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

C25H27N3O5S — CID 55755929

IUPACN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3cccc(C)c3)[nH]c2=O)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C25H27N3O5S/c1-17-7-6-8-18(15-17)21-11-10-20(25(30)27-21)24(29)26-19-9-12-22(33-2)23(16-19)34(31,32)28-13-4-3-5-14-28/h6-12,15-16H,3-5,13-14H2,1-2H3,(H,26,29)(H,27,30)
InChIKeyQEQPHSKHHHESJY-UHFFFAOYSA-N
MW481.57 g/mol
LogP3.79
Rot. Bonds6

About N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 55755929) has the molecular formula C25H27N3O5S and a molecular weight of 481.57 g/mol. Its IUPAC name is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID55755929
Molecular FormulaC25H27N3O5S
Molecular Weight481.57 g/mol
Exact Mass481.17
IUPAC NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3cccc(C)c3)[nH]c2=O)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C25H27N3O5S/c1-17-7-6-8-18(15-17)21-11-10-20(25(30)27-21)24(29)26-19-9-12-22(33-2)23(16-19)34(31,32)28-13-4-3-5-14-28/h6-12,15-16H,3-5,13-14H2,1-2H3,(H,26,29)(H,27,30)
InChIKeyQEQPHSKHHHESJY-UHFFFAOYSA-N
XLogP3.79
TPSA108.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.57
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 55755898
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 55752769
2,6-difluoro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 7742152
2-chloro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 46763944
N-[4-(methanesulfonamido)phenyl]-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 55791169
3,4-dimethoxy-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 26174301
3-amino-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 119677462
2-chloro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-5-[(4-methylphenyl)sulfonylamino]benzamide
CID 99939796
3,5-difluoro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 4874945
4-methoxy-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 7742149
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide
CID 4811508
(E)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)but-2-enamide
CID 6212937

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 55755929) is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is COc1ccc(NC(=O)c2ccc(-c3cccc(C)c3)[nH]c2=O)cc1S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is QEQPHSKHHHESJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O5S/c1-17-7-6-8-18(15-17)21-11-10-20(25(30)27-21)24(29)26-19-9-12-22(33-2)23(16-19)34(31,32)28-13-4-3-5-14-28/h6-12,15-16H,3-5,13-14H2,1-2H3,(H,26,29)(H,27,30).
What are the key properties of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 481.57 g/mol, XLogP of 3.79, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 55755929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).