6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

C18H12F3N3O2S — CID 25189760

IUPAC6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1cn2cc(-c3ccco3)cc(C(F)(F)F)c2n1
InChIInChI=1S/C18H12F3N3O2S/c19-18(20,21)13-7-11(15-4-1-5-26-15)9-24-10-14(23-16(13)24)17(25)22-8-12-3-2-6-27-12/h1-7,9-10H,8H2,(H,22,25)
InChIKeyDICRXAVKYLDZNO-UHFFFAOYSA-N
MW391.37 g/mol
LogP4.60
Rot. Bonds4

About 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 25189760) has the molecular formula C18H12F3N3O2S and a molecular weight of 391.37 g/mol. Its IUPAC name is 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID25189760
Molecular FormulaC18H12F3N3O2S
Molecular Weight391.37 g/mol
Exact Mass391.06
IUPAC Name6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1cn2cc(-c3ccco3)cc(C(F)(F)F)c2n1
InChIInChI=1S/C18H12F3N3O2S/c19-18(20,21)13-7-11(15-4-1-5-26-15)9-24-10-14(23-16(13)24)17(25)22-8-12-3-2-6-27-12/h1-7,9-10H,8H2,(H,22,25)
InChIKeyDICRXAVKYLDZNO-UHFFFAOYSA-N
XLogP4.60
TPSA59.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.37
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 25189760) is 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is O=C(NCc1cccs1)c1cn2cc(-c3ccco3)cc(C(F)(F)F)c2n1.
What is the InChIKey of 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is DICRXAVKYLDZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3N3O2S/c19-18(20,21)13-7-11(15-4-1-5-26-15)9-24-10-14(23-16(13)24)17(25)22-8-12-3-2-6-27-12/h1-7,9-10H,8H2,(H,22,25).
What are the key properties of 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 391.37 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 25189760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).