ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide

C25H24F3N3O2 — CID 142615465

IUPACethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide
SMILESCC.Cc1ccc(NC(=O)COc2ccc(-c3cnc4ccccn34)cc2)cc1C(F)(F)F
InChIInChI=1S/C23H18F3N3O2.C2H6/c1-15-5-8-17(12-19(15)23(24,25)26)28-22(30)14-31-18-9-6-16(7-10-18)20-13-27-21-4-2-3-11-29(20)21;1-2/h2-13H,14H2,1H3,(H,28,30);1-2H3
InChIKeyXUSZPGOJTRVCSJ-UHFFFAOYSA-N
MW455.48 g/mol
LogP6.37
Rot. Bonds5

About ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide

ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide (PubChem CID 142615465) has the molecular formula C25H24F3N3O2 and a molecular weight of 455.48 g/mol. Its IUPAC name is ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Nameethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide
PubChem CID142615465
Molecular FormulaC25H24F3N3O2
Molecular Weight455.48 g/mol
Exact Mass455.18
IUPAC Nameethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide
SMILESCC.Cc1ccc(NC(=O)COc2ccc(-c3cnc4ccccn34)cc2)cc1C(F)(F)F
InChIInChI=1S/C23H18F3N3O2.C2H6/c1-15-5-8-17(12-19(15)23(24,25)26)28-22(30)14-31-18-9-6-16(7-10-18)20-13-27-21-4-2-3-11-29(20)21;1-2/h2-13H,14H2,1H3,(H,28,30);1-2H3
InChIKeyXUSZPGOJTRVCSJ-UHFFFAOYSA-N
XLogP6.37
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.48
LogP ≤ 56.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
Imidazopyridine-urea,42
CID 10117977
(4-[3-[4-(2-Methoxyphenyl)piperazin-1-yl]butoxy]phenyl)imidazo[1,2-a]pyridine
CID 10479214
N-[4-[2-[2-fluoro-5-(trifluoromethyl)anilino]-1-methylbenzimidazol-5-yl]oxypyridin-2-yl]acetamide
CID 11476663
7-Methyl-3,6-bis(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179283
3-(4-Cyclopropyloxyphenyl)-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179286
5-Methyl-3,6-bis(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179296
N-propan-2-yl-4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]aniline
CID 134179300
3-[4-[(2-Methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179301
3,6-Bis(4-isopropoxyphenyl)imidazo[1,2-a]pyridine
CID 134179604
6-(2-Methyl-4-propan-2-yloxyphenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179844

Frequently Asked Questions

What is the IUPAC name of ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide (CID 142615465) is ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide is CC.Cc1ccc(NC(=O)COc2ccc(-c3cnc4ccccn34)cc2)cc1C(F)(F)F.
What is the InChIKey of ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is XUSZPGOJTRVCSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F3N3O2.C2H6/c1-15-5-8-17(12-19(15)23(24,25)26)28-22(30)14-31-18-9-6-16(7-10-18)20-13-27-21-4-2-3-11-29(20)21;1-2/h2-13H,14H2,1H3,(H,28,30);1-2H3.
What are the key properties of ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide?
ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 455.48 g/mol, XLogP of 6.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(4-imidazo[1,2-a]pyridin-3-ylphenoxy)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 142615465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).