2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide

C22H19FN4O4S — CID 59233724

IUPAC2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(NS(=O)(=O)c3cccc(OC)c3)cc12
InChIInChI=1S/C22H19FN4O4S/c1-24-22(28)20-19-12-16(26-32(29,30)18-5-3-4-17(13-18)31-2)10-11-27(19)25-21(20)14-6-8-15(23)9-7-14/h3-13,26H,1-2H3,(H,24,28)
InChIKeyZDJWEBFRCHFEAH-UHFFFAOYSA-N
MW454.48 g/mol
LogP3.31
Rot. Bonds6

About 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide

2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 59233724) has the molecular formula C22H19FN4O4S and a molecular weight of 454.48 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID59233724
Molecular FormulaC22H19FN4O4S
Molecular Weight454.48 g/mol
Exact Mass454.11
IUPAC Name2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(NS(=O)(=O)c3cccc(OC)c3)cc12
InChIInChI=1S/C22H19FN4O4S/c1-24-22(28)20-19-12-16(26-32(29,30)18-5-3-4-17(13-18)31-2)10-11-27(19)25-21(20)14-6-8-15(23)9-7-14/h3-13,26H,1-2H3,(H,24,28)
InChIKeyZDJWEBFRCHFEAH-UHFFFAOYSA-N
XLogP3.31
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.48
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide (CID 59233724) is 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide is CNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(NS(=O)(=O)c3cccc(OC)c3)cc12.
What is the InChIKey of 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is ZDJWEBFRCHFEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O4S/c1-24-22(28)20-19-12-16(26-32(29,30)18-5-3-4-17(13-18)31-2)10-11-27(19)25-21(20)14-6-8-15(23)9-7-14/h3-13,26H,1-2H3,(H,24,28).
What are the key properties of 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 454.48 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-[(3-methoxyphenyl)sulfonylamino]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 59233724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).