6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide

C17H18FN3O4S — CID 91914143

IUPAC6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide
SMILESNC(=O)c1ccc(OC2CCN(S(=O)(=O)c3cccc(F)c3)CC2)nc1
InChIInChI=1S/C17H18FN3O4S/c18-13-2-1-3-15(10-13)26(23,24)21-8-6-14(7-9-21)25-16-5-4-12(11-20-16)17(19)22/h1-5,10-11,14H,6-9H2,(H2,19,22)
InChIKeyMICKOTSWTLCYNO-UHFFFAOYSA-N
MW379.41 g/mol
LogP1.55
Rot. Bonds5

About 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide

6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide (PubChem CID 91914143) has the molecular formula C17H18FN3O4S and a molecular weight of 379.41 g/mol. Its IUPAC name is 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound Name6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide
PubChem CID91914143
Molecular FormulaC17H18FN3O4S
Molecular Weight379.41 g/mol
Exact Mass379.10
IUPAC Name6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide
SMILESNC(=O)c1ccc(OC2CCN(S(=O)(=O)c3cccc(F)c3)CC2)nc1
InChIInChI=1S/C17H18FN3O4S/c18-13-2-1-3-15(10-13)26(23,24)21-8-6-14(7-9-21)25-16-5-4-12(11-20-16)17(19)22/h1-5,10-11,14H,6-9H2,(H2,19,22)
InChIKeyMICKOTSWTLCYNO-UHFFFAOYSA-N
XLogP1.55
TPSA102.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.41
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide?
The IUPAC name of 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide (CID 91914143) is 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide?
The canonical SMILES for 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide is NC(=O)c1ccc(OC2CCN(S(=O)(=O)c3cccc(F)c3)CC2)nc1.
What is the InChIKey of 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide?
The InChIKey is MICKOTSWTLCYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O4S/c18-13-2-1-3-15(10-13)26(23,24)21-8-6-14(7-9-21)25-16-5-4-12(11-20-16)17(19)22/h1-5,10-11,14H,6-9H2,(H2,19,22).
What are the key properties of 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide?
6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide has a molecular weight of 379.41 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 91914143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).