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

C20H19F4N3O2 — CID 66991855

IUPACN-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)Nc1nc2ccc(F)cn2c1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H19F4N3O2/c1-19(2,3)29-11-16(28)26-18-17(27-10-14(21)8-9-15(27)25-18)12-4-6-13(7-5-12)20(22,23)24/h4-10H,11H2,1-3H3,(H,26,28)
InChIKeySVBMUDLBCWGDRD-UHFFFAOYSA-N
MW409.38 g/mol
LogP4.91
Rot. Bonds4

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

N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 66991855) has the molecular formula C20H19F4N3O2 and a molecular weight of 409.38 g/mol. Its IUPAC name is N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID66991855
Molecular FormulaC20H19F4N3O2
Molecular Weight409.38 g/mol
Exact Mass409.14
IUPAC NameN-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)Nc1nc2ccc(F)cn2c1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C20H19F4N3O2/c1-19(2,3)29-11-16(28)26-18-17(27-10-14(21)8-9-15(27)25-18)12-4-6-13(7-5-12)20(22,23)24/h4-10H,11H2,1-3H3,(H,26,28)
InChIKeySVBMUDLBCWGDRD-UHFFFAOYSA-N
XLogP4.91
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.38
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 66991855) is N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)(C)OCC(=O)Nc1nc2ccc(F)cn2c1-c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is SVBMUDLBCWGDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F4N3O2/c1-19(2,3)29-11-16(28)26-18-17(27-10-14(21)8-9-15(27)25-18)12-4-6-13(7-5-12)20(22,23)24/h4-10H,11H2,1-3H3,(H,26,28).
What are the key properties of N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 409.38 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-3-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 66991855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).