2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide

C19H10Cl2F3N3O2 — CID 57026635

IUPAC2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide
SMILESO=C(Nc1cccn2c(-c3ccoc3)c(C(F)(F)F)nc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H10Cl2F3N3O2/c20-11-3-1-4-12(21)14(11)18(28)25-13-5-2-7-27-15(10-6-8-29-9-10)16(19(22,23)24)26-17(13)27/h1-9H,(H,25,28)
InChIKeyXUFCSOCHGJKWBO-UHFFFAOYSA-N
MW440.21 g/mol
LogP6.17
Rot. Bonds3

About 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide

2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide (PubChem CID 57026635) has the molecular formula C19H10Cl2F3N3O2 and a molecular weight of 440.21 g/mol. Its IUPAC name is 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide
PubChem CID57026635
Molecular FormulaC19H10Cl2F3N3O2
Molecular Weight440.21 g/mol
Exact Mass439.01
IUPAC Name2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide
SMILESO=C(Nc1cccn2c(-c3ccoc3)c(C(F)(F)F)nc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H10Cl2F3N3O2/c20-11-3-1-4-12(21)14(11)18(28)25-13-5-2-7-27-15(10-6-8-29-9-10)16(19(22,23)24)26-17(13)27/h1-9H,(H,25,28)
InChIKeyXUFCSOCHGJKWBO-UHFFFAOYSA-N
XLogP6.17
TPSA59.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.21
LogP ≤ 56.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide (CID 57026635) is 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide is O=C(Nc1cccn2c(-c3ccoc3)c(C(F)(F)F)nc12)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide?
The InChIKey is XUFCSOCHGJKWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10Cl2F3N3O2/c20-11-3-1-4-12(21)14(11)18(28)25-13-5-2-7-27-15(10-6-8-29-9-10)16(19(22,23)24)26-17(13)27/h1-9H,(H,25,28).
What are the key properties of 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide?
2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide has a molecular weight of 440.21 g/mol, XLogP of 6.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[3-(furan-3-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyridin-8-yl]benzamide is sourced from PubChem (CID 57026635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).