6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C20H17F5N4O2 — CID 154655582

IUPAC6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cn2cc(C3CCOCC3)nc2cc1C(F)(F)F)c1cccc(C(F)F)n1
InChIInChI=1S/C20H17F5N4O2/c21-18(22)13-2-1-3-14(26-13)19(30)28-16-10-29-9-15(11-4-6-31-7-5-11)27-17(29)8-12(16)20(23,24)25/h1-3,8-11,18H,4-7H2,(H,28,30)
InChIKeyXTJIFFNDHAMDQI-UHFFFAOYSA-N
MW440.37 g/mol
LogP4.83
Rot. Bonds4

About 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655582) has the molecular formula C20H17F5N4O2 and a molecular weight of 440.37 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655582
Molecular FormulaC20H17F5N4O2
Molecular Weight440.37 g/mol
Exact Mass440.13
IUPAC Name6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESO=C(Nc1cn2cc(C3CCOCC3)nc2cc1C(F)(F)F)c1cccc(C(F)F)n1
InChIInChI=1S/C20H17F5N4O2/c21-18(22)13-2-1-3-14(26-13)19(30)28-16-10-29-9-15(11-4-6-31-7-5-11)27-17(29)8-12(16)20(23,24)25/h1-3,8-11,18H,4-7H2,(H,28,30)
InChIKeyXTJIFFNDHAMDQI-UHFFFAOYSA-N
XLogP4.83
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.37
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655582) is 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is O=C(Nc1cn2cc(C3CCOCC3)nc2cc1C(F)(F)F)c1cccc(C(F)F)n1.
What is the InChIKey of 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is XTJIFFNDHAMDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F5N4O2/c21-18(22)13-2-1-3-14(26-13)19(30)28-16-10-29-9-15(11-4-6-31-7-5-11)27-17(29)8-12(16)20(23,24)25/h1-3,8-11,18H,4-7H2,(H,28,30).
What are the key properties of 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 440.37 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[2-(oxan-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).