N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide

C15H10F2N4O3S — CID 52935623

IUPACN-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cnn(S(=O)(=O)c2ccc(F)cc2F)c1)c1ccccn1
InChIInChI=1S/C15H10F2N4O3S/c16-10-4-5-14(12(17)7-10)25(23,24)21-9-11(8-19-21)20-15(22)13-3-1-2-6-18-13/h1-9H,(H,20,22)
InChIKeyTWSNBRCTNUIBRT-UHFFFAOYSA-N
MW364.33 g/mol
LogP2.05
Rot. Bonds4

About N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide

N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide (PubChem CID 52935623) has the molecular formula C15H10F2N4O3S and a molecular weight of 364.33 g/mol. Its IUPAC name is N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
PubChem CID52935623
Molecular FormulaC15H10F2N4O3S
Molecular Weight364.33 g/mol
Exact Mass364.04
IUPAC NameN-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cnn(S(=O)(=O)c2ccc(F)cc2F)c1)c1ccccn1
InChIInChI=1S/C15H10F2N4O3S/c16-10-4-5-14(12(17)7-10)25(23,24)21-9-11(8-19-21)20-15(22)13-3-1-2-6-18-13/h1-9H,(H,20,22)
InChIKeyTWSNBRCTNUIBRT-UHFFFAOYSA-N
XLogP2.05
TPSA93.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide (CID 52935623) is N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide is O=C(Nc1cnn(S(=O)(=O)c2ccc(F)cc2F)c1)c1ccccn1.
What is the InChIKey of N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The InChIKey is TWSNBRCTNUIBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N4O3S/c16-10-4-5-14(12(17)7-10)25(23,24)21-9-11(8-19-21)20-15(22)13-3-1-2-6-18-13/h1-9H,(H,20,22).
What are the key properties of N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide has a molecular weight of 364.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-difluorophenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 52935623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).