2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide

C21H16F3N5O2 — CID 155446084

IUPAC2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide
SMILESCc1cnc(NC(=O)COc2ccc(-c3cnc4ccccn34)cn2)cc1C(F)(F)F
InChIInChI=1S/C21H16F3N5O2/c1-13-9-25-17(8-15(13)21(22,23)24)28-19(30)12-31-20-6-5-14(10-27-20)16-11-26-18-4-2-3-7-29(16)18/h2-11H,12H2,1H3,(H,25,28,30)
InChIKeyHOVYGANMWZDWFP-UHFFFAOYSA-N
MW427.39 g/mol
LogP4.14
Rot. Bonds5

About 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide

2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide (PubChem CID 155446084) has the molecular formula C21H16F3N5O2 and a molecular weight of 427.39 g/mol. Its IUPAC name is 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide
PubChem CID155446084
Molecular FormulaC21H16F3N5O2
Molecular Weight427.39 g/mol
Exact Mass427.13
IUPAC Name2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide
SMILESCc1cnc(NC(=O)COc2ccc(-c3cnc4ccccn34)cn2)cc1C(F)(F)F
InChIInChI=1S/C21H16F3N5O2/c1-13-9-25-17(8-15(13)21(22,23)24)28-19(30)12-31-20-6-5-14(10-27-20)16-11-26-18-4-2-3-7-29(16)18/h2-11H,12H2,1H3,(H,25,28,30)
InChIKeyHOVYGANMWZDWFP-UHFFFAOYSA-N
XLogP4.14
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.39
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide?
The IUPAC name of 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide (CID 155446084) is 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide?
The canonical SMILES for 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide is Cc1cnc(NC(=O)COc2ccc(-c3cnc4ccccn34)cn2)cc1C(F)(F)F.
What is the InChIKey of 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide?
The InChIKey is HOVYGANMWZDWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3N5O2/c1-13-9-25-17(8-15(13)21(22,23)24)28-19(30)12-31-20-6-5-14(10-27-20)16-11-26-18-4-2-3-7-29(16)18/h2-11H,12H2,1H3,(H,25,28,30).
What are the key properties of 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide?
2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide has a molecular weight of 427.39 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-imidazo[1,2-a]pyridin-3-yl-2-pyridinyl)oxy]-N-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]acetamide is sourced from PubChem (CID 155446084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).