N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

C17H15F3N4O3 — CID 59443910

IUPACN-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCN(C)C(=O)CNC(=O)c1cn2cc(-c3ccoc3)cc(C(F)(F)F)c2n1
InChIInChI=1S/C17H15F3N4O3/c1-23(2)14(25)6-21-16(26)13-8-24-7-11(10-3-4-27-9-10)5-12(15(24)22-13)17(18,19)20/h3-5,7-9H,6H2,1-2H3,(H,21,26)
InChIKeyLYPGITLGOGFCEA-UHFFFAOYSA-N
MW380.33 g/mol
LogP2.43
Rot. Bonds4

About N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 59443910) has the molecular formula C17H15F3N4O3 and a molecular weight of 380.33 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID59443910
Molecular FormulaC17H15F3N4O3
Molecular Weight380.33 g/mol
Exact Mass380.11
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCN(C)C(=O)CNC(=O)c1cn2cc(-c3ccoc3)cc(C(F)(F)F)c2n1
InChIInChI=1S/C17H15F3N4O3/c1-23(2)14(25)6-21-16(26)13-8-24-7-11(10-3-4-27-9-10)5-12(15(24)22-13)17(18,19)20/h3-5,7-9H,6H2,1-2H3,(H,21,26)
InChIKeyLYPGITLGOGFCEA-UHFFFAOYSA-N
XLogP2.43
TPSA79.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 59443910) is N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is CN(C)C(=O)CNC(=O)c1cn2cc(-c3ccoc3)cc(C(F)(F)F)c2n1.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is LYPGITLGOGFCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N4O3/c1-23(2)14(25)6-21-16(26)13-8-24-7-11(10-3-4-27-9-10)5-12(15(24)22-13)17(18,19)20/h3-5,7-9H,6H2,1-2H3,(H,21,26).
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 380.33 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 59443910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).