N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide

C22H14F5N3O2 — CID 66991969

IUPACN-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1nc2ccc(F)cn2c1-c1ccc(OC(F)(F)F)c(F)c1
InChIInChI=1S/C22H14F5N3O2/c23-15-7-9-18-28-21(29-19(31)10-13-4-2-1-3-5-13)20(30(18)12-15)14-6-8-17(16(24)11-14)32-22(25,26)27/h1-9,11-12H,10H2,(H,29,31)
InChIKeyRQZVHKFDFIWOOE-UHFFFAOYSA-N
MW447.36 g/mol
LogP5.36
Rot. Bonds5

About N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide

N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide (PubChem CID 66991969) has the molecular formula C22H14F5N3O2 and a molecular weight of 447.36 g/mol. Its IUPAC name is N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide
PubChem CID66991969
Molecular FormulaC22H14F5N3O2
Molecular Weight447.36 g/mol
Exact Mass447.10
IUPAC NameN-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1nc2ccc(F)cn2c1-c1ccc(OC(F)(F)F)c(F)c1
InChIInChI=1S/C22H14F5N3O2/c23-15-7-9-18-28-21(29-19(31)10-13-4-2-1-3-5-13)20(30(18)12-15)14-6-8-17(16(24)11-14)32-22(25,26)27/h1-9,11-12H,10H2,(H,29,31)
InChIKeyRQZVHKFDFIWOOE-UHFFFAOYSA-N
XLogP5.36
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.36
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(3,4-difluorophenyl)-6-fluoroimidazo[1,2-a]pyridin-2-yl]-2-(4-fluorophenyl)acetamide
CID 66992002
2-(4-fluorophenyl)-N-(6-fluoro-3-phenylimidazo[1,2-a]pyridin-2-yl)acetamide
CID 25196652
N-[6-fluoro-3-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-3,3-dimethylbutanamide
CID 66991059
2-cyclopropyl-N-[6-fluoro-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]acetamide
CID 66991488
N-[3-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide
CID 66991442
3-cyano-N-[6-fluoro-3-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-3-methylbutanamide
CID 66991766
N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 66991855
2-(3-fluorophenyl)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 24525372
N-[6-fluoro-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-2-yl]-2-phenylpropanamide
CID 66991435
N-[6-fluoro-3-(4-fluorophenyl)imidazo[1,2-a]pyridin-2-yl]-3,5,5-trimethylhexanamide
CID 66991726
N-(6-fluoro-3-pyridin-2-ylimidazo[1,2-a]pyridin-2-yl)-3,3-dimethylbutanamide
CID 25196868
N-[3-(cyclohexylmethyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide
CID 66991399

Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide?
The IUPAC name of N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide (CID 66991969) is N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide.
What is the SMILES notation for N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide?
The canonical SMILES for N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide is O=C(Cc1ccccc1)Nc1nc2ccc(F)cn2c1-c1ccc(OC(F)(F)F)c(F)c1.
What is the InChIKey of N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide?
The InChIKey is RQZVHKFDFIWOOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F5N3O2/c23-15-7-9-18-28-21(29-19(31)10-13-4-2-1-3-5-13)20(30(18)12-15)14-6-8-17(16(24)11-14)32-22(25,26)27/h1-9,11-12H,10H2,(H,29,31).
What are the key properties of N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide?
N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide has a molecular weight of 447.36 g/mol, XLogP of 5.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-3-[3-fluoro-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-phenylacetamide is sourced from PubChem (CID 66991969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).