lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride

C75H75Cl4LiN26O7 — CID 157125655

IUPAClithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride
SMILESC.COC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)cn1.COC(=O)c1ncn[nH]1.Cl.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(NCc1ncn2ccc(Cl)cc12)c1ncn(Cc2cn3cc(C4CC4)ccc3n2)n1.O=C([O-])c1cn(Cc2cn3nc(C4CC4)ccc3n2)nn1.[Li+]
InChIInChI=1S/C22H19ClN8O.C16H16N4O2.C13H12N6O2.C11H11ClN2.C8H8ClN3.C4H5N3O2.CH4.ClH.Li/c23-16-5-6-29-12-25-18(19(29)7-16)8-24-22(32)21-26-13-31(28-21)11-17-10-30-9-15(14-1-2-14)3-4-20(30)27-17;1-22-16(21)14-9-19(10-17-14)7-13-8-20-6-12(11-2-3-11)4-5-15(20)18-13;20-13(21)11-7-18(17-15-11)5-9-6-19-12(14-9)4-3-10(16-19)8-1-2-8;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-9-4(8)3-5-2-6-7-3;;;/h3-7,9-10,12-14H,1-2,8,11H2,(H,24,32);4-6,8-11H,2-3,7H2,1H3;3-4,6-8H,1-2,5H2,(H,20,21);3-4,6-8H,1-2,5H2;1-3,5H,4,10H2;2H,1H3,(H,5,6,7);1H4;1H;/q;;;;;;;;+1/p-1
InChIKeyKMUIAEPCOCHSTK-UHFFFAOYSA-M
MW1601.35 g/mol
LogP6.99
Rot. Bonds18

About lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride

lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride (PubChem CID 157125655) has the molecular formula C75H75Cl4LiN26O7 and a molecular weight of 1601.35 g/mol. Its IUPAC name is lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride.

Molecular Properties

Compound Namelithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride
PubChem CID157125655
Molecular FormulaC75H75Cl4LiN26O7
Molecular Weight1601.35 g/mol
Exact Mass1598.52
IUPAC Namelithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride
SMILESC.COC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)cn1.COC(=O)c1ncn[nH]1.Cl.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(NCc1ncn2ccc(Cl)cc12)c1ncn(Cc2cn3cc(C4CC4)ccc3n2)n1.O=C([O-])c1cn(Cc2cn3nc(C4CC4)ccc3n2)nn1.[Li+]
InChIInChI=1S/C22H19ClN8O.C16H16N4O2.C13H12N6O2.C11H11ClN2.C8H8ClN3.C4H5N3O2.CH4.ClH.Li/c23-16-5-6-29-12-25-18(19(29)7-16)8-24-22(32)21-26-13-31(28-21)11-17-10-30-9-15(14-1-2-14)3-4-20(30)27-17;1-22-16(21)14-9-19(10-17-14)7-13-8-20-6-12(11-2-3-11)4-5-15(20)18-13;20-13(21)11-7-18(17-15-11)5-9-6-19-12(14-9)4-3-10(16-19)8-1-2-8;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-9-4(8)3-5-2-6-7-3;;;/h3-7,9-10,12-14H,1-2,8,11H2,(H,24,32);4-6,8-11H,2-3,7H2,1H3;3-4,6-8H,1-2,5H2,(H,20,21);3-4,6-8H,1-2,5H2;1-3,5H,4,10H2;2H,1H3,(H,5,6,7);1H4;1H;/q;;;;;;;;+1/p-1
InChIKeyKMUIAEPCOCHSTK-UHFFFAOYSA-M
XLogP6.99
TPSA385.35 Ų
H-Bond Donors3
H-Bond Acceptors31
Rotatable Bonds18
Heavy Atoms113
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001601.35
LogP ≤ 56.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride?
The IUPAC name of lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride (CID 157125655) is lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride.
What is the SMILES notation for lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride?
The canonical SMILES for lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride is C.COC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)cn1.COC(=O)c1ncn[nH]1.Cl.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(NCc1ncn2ccc(Cl)cc12)c1ncn(Cc2cn3cc(C4CC4)ccc3n2)n1.O=C([O-])c1cn(Cc2cn3nc(C4CC4)ccc3n2)nn1.[Li+].
What is the InChIKey of lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride?
The InChIKey is KMUIAEPCOCHSTK-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H19ClN8O.C16H16N4O2.C13H12N6O2.C11H11ClN2.C8H8ClN3.C4H5N3O2.CH4.ClH.Li/c23-16-5-6-29-12-25-18(19(29)7-16)8-24-22(32)21-26-13-31(28-21)11-17-10-30-9-15(14-1-2-14)3-4-20(30)27-17;1-22-16(21)14-9-19(10-17-14)7-13-8-20-6-12(11-2-3-11)4-5-15(20)18-13;20-13(21)11-7-18(17-15-11)5-9-6-19-12(14-9)4-3-10(16-19)8-1-2-8;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-9-4(8)3-5-2-6-7-3;;;/h3-7,9-10,12-14H,1-2,8,11H2,(H,24,32);4-6,8-11H,2-3,7H2,1H3;3-4,6-8H,1-2,5H2,(H,20,21);3-4,6-8H,1-2,5H2;1-3,5H,4,10H2;2H,1H3,(H,5,6,7);1H4;1H;/q;;;;;;;;+1/p-1.
What are the key properties of lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride?
lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride has a molecular weight of 1601.35 g/mol, XLogP of 6.99, 18 rotatable bonds, 3 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,2,4-triazole-3-carboxamide;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)methyl]triazole-4-carboxylate;methane;methyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]imidazole-4-carboxylate;methyl 1H-1,2,4-triazole-5-carboxylate;hydrochloride is sourced from PubChem (CID 157125655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).