8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide

C14H8ClF3N4O3S — CID 166317933

IUPAC8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(C(F)(F)F)cn1)c1cnc2c(Cl)cccn12
InChIInChI=1S/C14H8ClF3N4O3S/c15-9-2-1-5-22-10(7-20-12(9)22)13(23)21-26(24,25)11-4-3-8(6-19-11)14(16,17)18/h1-7H,(H,21,23)
InChIKeyFGFFKWZOOSUEBC-UHFFFAOYSA-N
MW404.76 g/mol
LogP2.52
Rot. Bonds3

About 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide

8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 166317933) has the molecular formula C14H8ClF3N4O3S and a molecular weight of 404.76 g/mol. Its IUPAC name is 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID166317933
Molecular FormulaC14H8ClF3N4O3S
Molecular Weight404.76 g/mol
Exact Mass404.00
IUPAC Name8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(C(F)(F)F)cn1)c1cnc2c(Cl)cccn12
InChIInChI=1S/C14H8ClF3N4O3S/c15-9-2-1-5-22-10(7-20-12(9)22)13(23)21-26(24,25)11-4-3-8(6-19-11)14(16,17)18/h1-7H,(H,21,23)
InChIKeyFGFFKWZOOSUEBC-UHFFFAOYSA-N
XLogP2.52
TPSA93.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.76
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 166317933) is 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide is O=C(NS(=O)(=O)c1ccc(C(F)(F)F)cn1)c1cnc2c(Cl)cccn12.
What is the InChIKey of 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is FGFFKWZOOSUEBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClF3N4O3S/c15-9-2-1-5-22-10(7-20-12(9)22)13(23)21-26(24,25)11-4-3-8(6-19-11)14(16,17)18/h1-7H,(H,21,23).
What are the key properties of 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide?
8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 404.76 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 166317933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).