N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide

C24H17BrFN7O2 — CID 177296677

About N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide

N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide (PubChem CID 177296677) has the molecular formula C24H17BrFN7O2 and a molecular weight of 534.35 g/mol. Its IUPAC name is N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

• Compound Name: N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
• PubChem CID: 177296677
• Molecular Formula: C24H17BrFN7O2
• Molecular Weight: 534.35 g/mol
• Exact Mass: 533.06
• IUPAC Name: N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
• SMILES: N#Cc1cc(C2CC2)cn2cc(Cc3nnc(C(=O)NCc4ncn5ccc(Br)c(F)c45)o3)cc12
• InChI: InChI=1S/C24H17BrFN7O2/c25-17-3-4-32-12-29-18(22(32)21(17)26)9-28-23(34)24-31-30-20(35-24)6-13-5-19-15(8-27)7-16(14-1-2-14)11-33(19)10-13/h3-5,7,10-12,14H,1-2,6,9H2,(H,28,34)
• InChIKey: MTQBJNFBYVFOFV-UHFFFAOYSA-N
• XLogP: 4.14
• TPSA: 113.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	534.35
LogP ≤ 5	4.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?

The IUPAC name of N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide (CID 177296677) is N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide.

What is the SMILES notation for N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?

The canonical SMILES for N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide is N#Cc1cc(C2CC2)cn2cc(Cc3nnc(C(=O)NCc4ncn5ccc(Br)c(F)c45)o3)cc12.

What is the InChIKey of N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?

The InChIKey is MTQBJNFBYVFOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17BrFN7O2/c25-17-3-4-32-12-29-18(22(32)21(17)26)9-28-23(34)24-31-30-20(35-24)6-13-5-19-15(8-27)7-16(14-1-2-14)11-33(19)10-13/h3-5,7,10-12,14H,1-2,6,9H2,(H,28,34).

What are the key properties of N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide?

N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 534.35 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(7-bromo-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylindolizin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 177296677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).