N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide

C18H12FN5O — CID 67140847

IUPACN-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)n1)c1cn2cc(-c3ccccn3)ccc2n1
InChIInChI=1S/C18H12FN5O/c19-15-5-3-6-16(22-15)23-18(25)14-11-24-10-12(7-8-17(24)21-14)13-4-1-2-9-20-13/h1-11H,(H,22,23,25)
InChIKeyCHYWJGJBXBECDR-UHFFFAOYSA-N
MW333.33 g/mol
LogP3.18
Rot. Bonds3

About N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide

N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 67140847) has the molecular formula C18H12FN5O and a molecular weight of 333.33 g/mol. Its IUPAC name is N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID67140847
Molecular FormulaC18H12FN5O
Molecular Weight333.33 g/mol
Exact Mass333.10
IUPAC NameN-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)n1)c1cn2cc(-c3ccccn3)ccc2n1
InChIInChI=1S/C18H12FN5O/c19-15-5-3-6-16(22-15)23-18(25)14-11-24-10-12(7-8-17(24)21-14)13-4-1-2-9-20-13/h1-11H,(H,22,23,25)
InChIKeyCHYWJGJBXBECDR-UHFFFAOYSA-N
XLogP3.18
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.33
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide (CID 67140847) is N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide is O=C(Nc1cccc(F)n1)c1cn2cc(-c3ccccn3)ccc2n1.
What is the InChIKey of N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is CHYWJGJBXBECDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5O/c19-15-5-3-6-16(22-15)23-18(25)14-11-24-10-12(7-8-17(24)21-14)13-4-1-2-9-20-13/h1-11H,(H,22,23,25).
What are the key properties of N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 333.33 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 67140847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).