2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide

C22H19FN4O2 — CID 24821581

IUPAC2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide
SMILESNC(=O)Cc1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1
InChIInChI=1S/C22H19FN4O2/c23-16-8-5-14(6-9-16)12-25-22-21(17-3-1-2-4-18(17)28)26-20-10-7-15(11-19(24)29)13-27(20)22/h1-10,13,25,28H,11-12H2,(H2,24,29)
InChIKeyBAVPOSZDRKRBIN-UHFFFAOYSA-N
MW390.42 g/mol
LogP3.49
Rot. Bonds6

About 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide

2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide (PubChem CID 24821581) has the molecular formula C22H19FN4O2 and a molecular weight of 390.42 g/mol. Its IUPAC name is 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide.

Molecular Properties

Compound Name2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide
PubChem CID24821581
Molecular FormulaC22H19FN4O2
Molecular Weight390.42 g/mol
Exact Mass390.15
IUPAC Name2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide
SMILESNC(=O)Cc1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1
InChIInChI=1S/C22H19FN4O2/c23-16-8-5-14(6-9-16)12-25-22-21(17-3-1-2-4-18(17)28)26-20-10-7-15(11-19(24)29)13-27(20)22/h1-10,13,25,28H,11-12H2,(H2,24,29)
InChIKeyBAVPOSZDRKRBIN-UHFFFAOYSA-N
XLogP3.49
TPSA92.65 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.42
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide?
The IUPAC name of 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide (CID 24821581) is 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide.
What is the SMILES notation for 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide?
The canonical SMILES for 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide is NC(=O)Cc1ccc2nc(-c3ccccc3O)c(NCc3ccc(F)cc3)n2c1.
What is the InChIKey of 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide?
The InChIKey is BAVPOSZDRKRBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O2/c23-16-8-5-14(6-9-16)12-25-22-21(17-3-1-2-4-18(17)28)26-20-10-7-15(11-19(24)29)13-27(20)22/h1-10,13,25,28H,11-12H2,(H2,24,29).
What are the key properties of 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide?
2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide has a molecular weight of 390.42 g/mol, XLogP of 3.49, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-fluorophenyl)methylamino]-2-(2-hydroxyphenyl)imidazo[1,2-a]pyridin-6-yl]acetamide is sourced from PubChem (CID 24821581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).