N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

C21H14F4N4O2 — CID 162763684

IUPACN-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1cnccc1F)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C21H14F4N4O2/c22-15-7-8-26-10-16(15)28-20(30)17-11-29-9-3-5-14(19(29)27-17)13-4-1-2-6-18(13)31-12-21(23,24)25/h1-11H,12H2,(H,28,30)
InChIKeyQXOFPZOTEIVUGF-UHFFFAOYSA-N
MW430.36 g/mol
LogP4.73
Rot. Bonds5

About N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 162763684) has the molecular formula C21H14F4N4O2 and a molecular weight of 430.36 g/mol. Its IUPAC name is N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID162763684
Molecular FormulaC21H14F4N4O2
Molecular Weight430.36 g/mol
Exact Mass430.11
IUPAC NameN-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1cnccc1F)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C21H14F4N4O2/c22-15-7-8-26-10-16(15)28-20(30)17-11-29-9-3-5-14(19(29)27-17)13-4-1-2-6-18(13)31-12-21(23,24)25/h1-11H,12H2,(H,28,30)
InChIKeyQXOFPZOTEIVUGF-UHFFFAOYSA-N
XLogP4.73
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.36
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 162763684) is N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is O=C(Nc1cnccc1F)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1.
What is the InChIKey of N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is QXOFPZOTEIVUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F4N4O2/c22-15-7-8-26-10-16(15)28-20(30)17-11-29-9-3-5-14(19(29)27-17)13-4-1-2-6-18(13)31-12-21(23,24)25/h1-11H,12H2,(H,28,30).
What are the key properties of N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 430.36 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 162763684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).