4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide

C17H18ClN3O4S — CID 122257113

IUPAC4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(S(=O)(=O)c3cccc(Cl)c3)C2)ccn1
InChIInChI=1S/C17H18ClN3O4S/c18-12-3-1-5-15(9-12)26(23,24)21-8-2-4-14(11-21)25-13-6-7-20-16(10-13)17(19)22/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,22)
InChIKeyAWJCOLUXMYOUMG-UHFFFAOYSA-N
MW395.87 g/mol
LogP2.07
Rot. Bonds5

About 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide

4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide (PubChem CID 122257113) has the molecular formula C17H18ClN3O4S and a molecular weight of 395.87 g/mol. Its IUPAC name is 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
PubChem CID122257113
Molecular FormulaC17H18ClN3O4S
Molecular Weight395.87 g/mol
Exact Mass395.07
IUPAC Name4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(S(=O)(=O)c3cccc(Cl)c3)C2)ccn1
InChIInChI=1S/C17H18ClN3O4S/c18-12-3-1-5-15(9-12)26(23,24)21-8-2-4-14(11-21)25-13-6-7-20-16(10-13)17(19)22/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,22)
InChIKeyAWJCOLUXMYOUMG-UHFFFAOYSA-N
XLogP2.07
TPSA102.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.87
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-(3-chloro-2-methylphenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
CID 122257105
4-[1-(4-ethoxyphenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
CID 122257087
4-[1-(2-methylquinolin-8-yl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide
CID 122257091
4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256720
4-[1-(1-methylsulfonylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256822
2-[1-(3-chlorophenyl)sulfonylpyrrolidin-3-yl]oxypyrazine
CID 90636398
4-[1-(phenylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256998
1-(3-chlorophenyl)sulfonyl-N-methylpiperidin-3-amine
CID 62536748
(3S)-1-(3-chlorophenyl)sulfonyl-N'-(cyclopropanecarbonyl)piperidine-3-carbohydrazide
CID 1445981
4-[[1-[(3-chlorophenyl)methyl]piperidin-4-yl]methoxy]pyridine-2-carboxamide
CID 166603390
4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256747
4-(1-butanoylpiperidin-3-yl)oxypyridine-2-carboxamide
CID 122256660

Frequently Asked Questions

What is the IUPAC name of 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide (CID 122257113) is 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide is NC(=O)c1cc(OC2CCCN(S(=O)(=O)c3cccc(Cl)c3)C2)ccn1.
What is the InChIKey of 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide?
The InChIKey is AWJCOLUXMYOUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O4S/c18-12-3-1-5-15(9-12)26(23,24)21-8-2-4-14(11-21)25-13-6-7-20-16(10-13)17(19)22/h1,3,5-7,9-10,14H,2,4,8,11H2,(H2,19,22).
What are the key properties of 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide?
4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide has a molecular weight of 395.87 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 122257113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).