N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide

C15H14FN5O2S — CID 56806205

IUPACN-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide
SMILESCCc1c(NS(=O)(=O)c2cncc(F)c2)n[nH]c1-c1ccncc1
InChIInChI=1S/C15H14FN5O2S/c1-2-13-14(10-3-5-17-6-4-10)19-20-15(13)21-24(22,23)12-7-11(16)8-18-9-12/h3-9H,2H2,1H3,(H2,19,20,21)
InChIKeySGQMDSWVHJFZCX-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.37
Rot. Bonds5

About N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide

N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide (PubChem CID 56806205) has the molecular formula C15H14FN5O2S and a molecular weight of 347.38 g/mol. Its IUPAC name is N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide
PubChem CID56806205
Molecular FormulaC15H14FN5O2S
Molecular Weight347.38 g/mol
Exact Mass347.09
IUPAC NameN-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide
SMILESCCc1c(NS(=O)(=O)c2cncc(F)c2)n[nH]c1-c1ccncc1
InChIInChI=1S/C15H14FN5O2S/c1-2-13-14(10-3-5-17-6-4-10)19-20-15(13)21-24(22,23)12-7-11(16)8-18-9-12/h3-9H,2H2,1H3,(H2,19,20,21)
InChIKeySGQMDSWVHJFZCX-UHFFFAOYSA-N
XLogP2.37
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide?
The IUPAC name of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide (CID 56806205) is N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide.
What is the SMILES notation for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide?
The canonical SMILES for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide is CCc1c(NS(=O)(=O)c2cncc(F)c2)n[nH]c1-c1ccncc1.
What is the InChIKey of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide?
The InChIKey is SGQMDSWVHJFZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN5O2S/c1-2-13-14(10-3-5-17-6-4-10)19-20-15(13)21-24(22,23)12-7-11(16)8-18-9-12/h3-9H,2H2,1H3,(H2,19,20,21).
What are the key properties of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide?
N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide has a molecular weight of 347.38 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-5-fluoropyridine-3-sulfonamide is sourced from PubChem (CID 56806205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).