lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline

C42H53Cl3LiN9O4S2Si2 — CID 157208273

About lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline

lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline (PubChem CID 157208273) has the molecular formula C42H53Cl3LiN9O4S2Si2 and a molecular weight of 981.55 g/mol. Its IUPAC name is lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline.

Molecular Properties

• Compound Name: lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline
• PubChem CID: 157208273
• Molecular Formula: C42H53Cl3LiN9O4S2Si2
• Molecular Weight: 981.55 g/mol
• Exact Mass: 979.24
• IUPAC Name: lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline
• SMILES: CNC(=O)c1cnc(Cl)cc1Cl.CNC(=O)c1cnc(Cl)cc1Nc1cccc(-c2csc(C)n2)c1OC.COc1c(N)cccc1-c1csc(C)n1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+]
• InChI: InChI=1S/C18H17ClN4O2S.C11H12N2OS.C7H6Cl2N2O.C6H18NSi2.Li/c1-10-22-15(9-26-10)11-5-4-6-13(17(11)25-3)23-14-7-16(19)21-8-12(14)18(24)20-2;1-7-13-10(6-15-7)8-4-3-5-9(12)11(8)14-2;1-10-7(12)4-3-11-6(9)2-5(4)8;1-8(2,3)7-9(4,5)6;/h4-9H,1-3H3,(H,20,24)(H,21,23);3-6H,12H2,1-2H3;2-3H,1H3,(H,10,12);1-6H3;/q;;;-1;+1
• InChIKey: ARPHOQQQLGWVFK-UHFFFAOYSA-N
• XLogP: 8.77
• TPSA: 180.37 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	981.55
LogP ≤ 5	8.77
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline?

The IUPAC name of lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline (CID 157208273) is lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline.

What is the SMILES notation for lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline?

The canonical SMILES for lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline is CNC(=O)c1cnc(Cl)cc1Cl.CNC(=O)c1cnc(Cl)cc1Nc1cccc(-c2csc(C)n2)c1OC.COc1c(N)cccc1-c1csc(C)n1.C[Si](C)(C)[N-][Si](C)(C)C.[Li+].

What is the InChIKey of lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline?

The InChIKey is ARPHOQQQLGWVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O2S.C11H12N2OS.C7H6Cl2N2O.C6H18NSi2.Li/c1-10-22-15(9-26-10)11-5-4-6-13(17(11)25-3)23-14-7-16(19)21-8-12(14)18(24)20-2;1-7-13-10(6-15-7)8-4-3-5-9(12)11(8)14-2;1-10-7(12)4-3-11-6(9)2-5(4)8;1-8(2,3)7-9(4,5)6;/h4-9H,1-3H3,(H,20,24)(H,21,23);3-6H,12H2,1-2H3;2-3H,1H3,(H,10,12);1-6H3;/q;;;-1;+1.

What are the key properties of lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline?

lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline has a molecular weight of 981.55 g/mol, XLogP of 8.77, 10 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;bis(trimethylsilyl)azanide;6-chloro-4-[2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)anilino]-N-methylpyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;2-methoxy-3-(2-methyl-1,3-thiazol-4-yl)aniline is sourced from PubChem (CID 157208273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).