N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide

C22H15ClF3N7O2 — CID 139488297

About N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide

N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide (PubChem CID 139488297) has the molecular formula C22H15ClF3N7O2 and a molecular weight of 501.86 g/mol. Its IUPAC name is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

• Compound Name: N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide
• PubChem CID: 139488297
• Molecular Formula: C22H15ClF3N7O2
• Molecular Weight: 501.86 g/mol
• Exact Mass: 501.09
• IUPAC Name: N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide
• SMILES: O=C(NCc1ncn2ccc(Cl)c(F)c12)c1nnc(C(F)(F)c2cn3cc(C4CC4)ccc3n2)o1
• InChI: InChI=1S/C22H15ClF3N7O2/c23-13-5-6-32-10-28-14(18(32)17(13)24)7-27-19(34)20-30-31-21(35-20)22(25,26)15-9-33-8-12(11-1-2-11)3-4-16(33)29-15/h3-6,8-11H,1-2,7H2,(H,27,34)
• InChIKey: OLBRMLDSQFMHGN-UHFFFAOYSA-N
• XLogP: 4.11
• TPSA: 102.62 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	501.86
LogP ≤ 5	4.11
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide (CID 139488297) is N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide.

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

The canonical SMILES for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide is O=C(NCc1ncn2ccc(Cl)c(F)c12)c1nnc(C(F)(F)c2cn3cc(C4CC4)ccc3n2)o1.

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

The InChIKey is OLBRMLDSQFMHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClF3N7O2/c23-13-5-6-32-10-28-14(18(32)17(13)24)7-27-19(34)20-30-31-21(35-20)22(25,26)15-9-33-8-12(11-1-2-11)3-4-16(33)29-15/h3-6,8-11H,1-2,7H2,(H,27,34).

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

N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 501.86 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)-difluoromethyl]-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 139488297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).