2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide

C23H11F8N3O2 — CID 22626681

IUPAC2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide
SMILESO=C(c1ccc(F)cc1)c1ccc2nc(NC(=O)C(F)(F)F)c(-c3ccc(C(F)(F)F)cc3F)n2c1
InChIInChI=1S/C23H11F8N3O2/c24-14-5-1-11(2-6-14)19(35)12-3-8-17-32-20(33-21(36)23(29,30)31)18(34(17)10-12)15-7-4-13(9-16(15)25)22(26,27)28/h1-10H,(H,33,36)
InChIKeyRFYGILDAPQOKAS-UHFFFAOYSA-N
MW513.34 g/mol
LogP6.03
Rot. Bonds4

About 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide

2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide (PubChem CID 22626681) has the molecular formula C23H11F8N3O2 and a molecular weight of 513.34 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide
PubChem CID22626681
Molecular FormulaC23H11F8N3O2
Molecular Weight513.34 g/mol
Exact Mass513.07
IUPAC Name2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide
SMILESO=C(c1ccc(F)cc1)c1ccc2nc(NC(=O)C(F)(F)F)c(-c3ccc(C(F)(F)F)cc3F)n2c1
InChIInChI=1S/C23H11F8N3O2/c24-14-5-1-11(2-6-14)19(35)12-3-8-17-32-20(33-21(36)23(29,30)31)18(34(17)10-12)15-7-4-13(9-16(15)25)22(26,27)28/h1-10H,(H,33,36)
InChIKeyRFYGILDAPQOKAS-UHFFFAOYSA-N
XLogP6.03
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.34
LogP ≤ 56.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-benzoyl-3-[2-fluoro-6-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2,2,2-trifluoroacetamide;N-[6-benzoyl-3-(2,3,4,5,6-pentafluorophenyl)imidazo[1,2-a]pyridin-2-yl]-2,2,2-trifluoroacetamide
CID 22626737
N-[[2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-6-yl]-(4-fluorophenyl)methylidene]hydroxylamine
CID 72586349
2,2,2-trifluoro-N-[6-[2-fluoro-4-(trifluoromethyl)benzoyl]imidazo[1,2-a]pyridin-2-yl]acetamide
CID 24936166
N-[3-(2,5-difluorophenyl)-6-[(E)-3-(methylaminooxy)-1-phenylprop-1-enyl]imidazo[1,2-a]pyridin-2-yl]-2,2,2-trifluoroacetamide
CID 18685794
4,4,4-trifluoro-N-[6-fluoro-3-[4-(trifluoromethyl)-2-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-3,3-dimethylbutanamide
CID 87377181
[2-amino-3-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-phenylmethanone
CID 22626644
[2-amino-3-(2,4,5-trifluorophenyl)imidazo[1,2-a]pyridin-6-yl]-phenylmethanone
CID 22626719
N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 66991855
[4-(trifluoromethyl)phenyl]-(3,4,5-trifluorophenyl)methanone
CID 62789591
2,2,2-trifluoro-N-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]acetamide
CID 129319730
N-[3-(3,4-difluorophenyl)-6-fluoroimidazo[1,2-a]pyridin-2-yl]-2-(4-fluorophenyl)acetamide
CID 66992002
[2-amino-3-(3,5-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-phenylmethanone
CID 22626660

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide (CID 22626681) is 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide is O=C(c1ccc(F)cc1)c1ccc2nc(NC(=O)C(F)(F)F)c(-c3ccc(C(F)(F)F)cc3F)n2c1.
What is the InChIKey of 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The InChIKey is RFYGILDAPQOKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H11F8N3O2/c24-14-5-1-11(2-6-14)19(35)12-3-8-17-32-20(33-21(36)23(29,30)31)18(34(17)10-12)15-7-4-13(9-16(15)25)22(26,27)28/h1-10H,(H,33,36).
What are the key properties of 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide?
2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide has a molecular weight of 513.34 g/mol, XLogP of 6.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[6-(4-fluorobenzoyl)-3-[2-fluoro-4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 22626681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).