N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide

C18H21N3O4S — CID 4811508

IUPACN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C18H21N3O4S/c1-25-16-9-8-14(20-18(22)15-7-3-4-10-19-15)13-17(16)26(23,24)21-11-5-2-6-12-21/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,20,22)
InChIKeyUSDTYMYDBLNANY-UHFFFAOYSA-N
MW375.45 g/mol
LogP2.52
Rot. Bonds5

About N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide

N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide (PubChem CID 4811508) has the molecular formula C18H21N3O4S and a molecular weight of 375.45 g/mol. Its IUPAC name is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide
PubChem CID4811508
Molecular FormulaC18H21N3O4S
Molecular Weight375.45 g/mol
Exact Mass375.13
IUPAC NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C18H21N3O4S/c1-25-16-9-8-14(20-18(22)15-7-3-4-10-19-15)13-17(16)26(23,24)21-11-5-2-6-12-21/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,20,22)
InChIKeyUSDTYMYDBLNANY-UHFFFAOYSA-N
XLogP2.52
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethoxy-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 26174301
2-methoxy-5-(pyridine-2-carbonylamino)benzenesulfonyl chloride
CID 43093324
2,6-difluoro-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 7742152
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
3-amino-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide
CID 119677462
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide
CID 55755749
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)propanamide
CID 26851836
2-(2-methoxyphenyl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 4800928
2-(2-hydroxyphenoxy)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 8933983
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-1-oxidopyridin-1-ium-4-carboxamide
CID 8890703
1-tert-butyl-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)urea
CID 4803267

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide?
The IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide (CID 4811508) is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide?
The InChIKey is USDTYMYDBLNANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4S/c1-25-16-9-8-14(20-18(22)15-7-3-4-10-19-15)13-17(16)26(23,24)21-11-5-2-6-12-21/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,20,22).
What are the key properties of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide?
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide has a molecular weight of 375.45 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 4811508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).