lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride

C91H94BrCl3F2LiN29O13 — CID 161355123

About lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride

lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride (PubChem CID 161355123) has the molecular formula C91H94BrCl3F2LiN29O13 and a molecular weight of 2033.14 g/mol. Its IUPAC name is lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride.

Molecular Properties

• Compound Name: lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride
• PubChem CID: 161355123
• Molecular Formula: C91H94BrCl3F2LiN29O13
• Molecular Weight: 2033.14 g/mol
• Exact Mass: 2029.60
• IUPAC Name: lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride
• SMILES: COC(=O)c1cn(Cc2cc3cc(C4CC4)cc(Br)n3n2)nn1.COC(=O)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.Cl.NCc1ncn2ccc(Cl)c(F)c12.O.O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.O=C(O)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.O=C1CCCN1.[Li+].[OH-]
• InChI: InChI=1S/C27H24ClFN8O2.C19H20N6O3.C18H18N6O3.C15H14BrN5O2.C8H7ClFN3.C4H7NO.ClH.Li.2H2O/c28-20-7-9-34-15-30-21(27(34)26(20)29)5-6-23(38)22-14-35(33-31-22)13-18-12-19-10-17(16-3-4-16)11-24(37(19)32-18)36-8-1-2-25(36)39;1-28-19(27)16-11-23(22-20-16)10-14-9-15-7-13(12-4-5-12)8-17(25(15)21-14)24-6-2-3-18(24)26;25-17-2-1-5-23(17)16-7-12(11-3-4-11)6-14-8-13(20-24(14)16)9-22-10-15(18(26)27)19-21-22;1-23-15(22)13-8-20(19-17-13)7-11-6-12-4-10(9-2-3-9)5-14(16)21(12)18-11;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;6-4-2-1-3-5-4;;;;/h7,9-12,14-16H,1-6,8,13H2;7-9,11-12H,2-6,10H2,1H3;6-8,10-11H,1-5,9H2,(H,26,27);4-6,8-9H,2-3,7H2,1H3;1-2,4H,3,11H2;1-3H2,(H,5,6);1H;;2*1H2/q;;;;;;;+1;;/p-1
• InChIKey: WECAQBZVCUBNCN-UHFFFAOYSA-M
• XLogP: 7.98
• TPSA: 511.16 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 36
• Rotatable Bonds: 23
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2033.14
LogP ≤ 5	7.98
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride?

The IUPAC name of lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride (CID 161355123) is lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride.

What is the SMILES notation for lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride?

The canonical SMILES for lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride is COC(=O)c1cn(Cc2cc3cc(C4CC4)cc(Br)n3n2)nn1.COC(=O)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.Cl.NCc1ncn2ccc(Cl)c(F)c12.O.O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.O=C(O)c1cn(Cc2cc3cc(C4CC4)cc(N4CCCC4=O)n3n2)nn1.O=C1CCCN1.[Li+].[OH-].

What is the InChIKey of lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride?

The InChIKey is WECAQBZVCUBNCN-UHFFFAOYSA-M. The full InChI is InChI=1S/C27H24ClFN8O2.C19H20N6O3.C18H18N6O3.C15H14BrN5O2.C8H7ClFN3.C4H7NO.ClH.Li.2H2O/c28-20-7-9-34-15-30-21(27(34)26(20)29)5-6-23(38)22-14-35(33-31-22)13-18-12-19-10-17(16-3-4-16)11-24(37(19)32-18)36-8-1-2-25(36)39;1-28-19(27)16-11-23(22-20-16)10-14-9-15-7-13(12-4-5-12)8-17(25(15)21-14)24-6-2-3-18(24)26;25-17-2-1-5-23(17)16-7-12(11-3-4-11)6-14-8-13(20-24(14)16)9-22-10-15(18(26)27)19-21-22;1-23-15(22)13-8-20(19-17-13)7-11-6-12-4-10(9-2-3-9)5-14(16)21(12)18-11;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;6-4-2-1-3-5-4;;;;/h7,9-12,14-16H,1-6,8,13H2;7-9,11-12H,2-6,10H2,1H3;6-8,10-11H,1-5,9H2,(H,26,27);4-6,8-9H,2-3,7H2,1H3;1-2,4H,3,11H2;1-3H2,(H,5,6);1H;;2*1H2/q;;;;;;;+1;;/p-1.

What are the key properties of lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride?

lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride has a molecular weight of 2033.14 g/mol, XLogP of 7.98, 23 rotatable bonds, 3 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[2-[[4-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]triazol-1-yl]methyl]-5-cyclopropylpyrazolo[1,5-a]pyridin-7-yl]pyrrolidin-2-one;1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(7-bromo-5-cyclopropylpyrazolo[1,5-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[5-cyclopropyl-7-(2-oxopyrrolidin-1-yl)pyrazolo[1,5-a]pyridin-2-yl]methyl]triazole-4-carboxylate;pyrrolidin-2-one;hydroxide;hydrate;hydrochloride is sourced from PubChem (CID 161355123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).