3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide

C21H17FN4O2 — CID 24822034

IUPAC3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESNC(=O)c1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1
InChIInChI=1S/C21H17FN4O2/c22-15-8-5-13(6-9-15)11-24-21-19(16-3-1-2-4-17(16)27)25-18-10-7-14(20(23)28)12-26(18)21/h1-10,12,24,27H,11H2,(H2,23,28)
InChIKeyAXFGWYYNBDDKII-UHFFFAOYSA-N
MW376.39 g/mol
LogP3.56
Rot. Bonds5

About 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide

3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 24822034) has the molecular formula C21H17FN4O2 and a molecular weight of 376.39 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID24822034
Molecular FormulaC21H17FN4O2
Molecular Weight376.39 g/mol
Exact Mass376.13
IUPAC Name3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESNC(=O)c1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1
InChIInChI=1S/C21H17FN4O2/c22-15-8-5-13(6-9-15)11-24-21-19(16-3-1-2-4-17(16)27)25-18-10-7-14(20(23)28)12-26(18)21/h1-10,12,24,27H,11H2,(H2,23,28)
InChIKeyAXFGWYYNBDDKII-UHFFFAOYSA-N
XLogP3.56
TPSA92.65 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 53.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 24822034) is 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide is NC(=O)c1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1.
What is the InChIKey of 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is AXFGWYYNBDDKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O2/c22-15-8-5-13(6-9-15)11-24-21-19(16-3-1-2-4-17(16)27)25-18-10-7-14(20(23)28)12-26(18)21/h1-10,12,24,27H,11H2,(H2,23,28).
What are the key properties of 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 376.39 g/mol, XLogP of 3.56, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 24822034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).