lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine

C73H84Cl3F3LiN23O6S2Si2 — CID 158138843

IUPAClithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine
SMILESCNC(=O)c1cnc(Cl)cc1Cl.CNC(=O)c1cnc(Cl)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1S(C)(=O)=O.CSc1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.Nc1ccc(F)cn1.[Li+]
InChIInChI=1S/C18H17FN6O3S.C18H17FN6O.C13H13ClN4O.C7H6Cl2N2O.C6H8N2S.C6H18NSi2.C5H5FN2.Li/c1-20-18(26)12-10-23-16(25-15-6-5-11(19)9-22-15)8-13(12)24-17-14(29(2,27)28)4-3-7-21-17;1-11-4-3-7-21-17(11)24-14-8-16(23-10-13(14)18(26)20-2)25-15-6-5-12(19)9-22-15;1-8-4-3-5-16-12(8)18-10-6-11(14)17-7-9(10)13(19)15-2;1-10-7(12)4-3-11-6(9)2-5(4)8;1-9-5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;6-4-1-2-5(7)8-3-4;/h3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-7H,1-2H3,(H,15,19)(H,16,17,18);2-3H,1H3,(H,10,12);2-4H,1H3,(H2,7,8);1-6H3;1-3H,(H2,7,8);/q;;;;;-1;;+1
InChIKeyFTROJONYIIVTKF-UHFFFAOYSA-N
MW1670.23 g/mol
LogP11.94
Rot. Bonds18

About lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine

lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine (PubChem CID 158138843) has the molecular formula C73H84Cl3F3LiN23O6S2Si2 and a molecular weight of 1670.23 g/mol. Its IUPAC name is lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine.

Molecular Properties

Compound Namelithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine
PubChem CID158138843
Molecular FormulaC73H84Cl3F3LiN23O6S2Si2
Molecular Weight1670.23 g/mol
Exact Mass1667.51
IUPAC Namelithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine
SMILESCNC(=O)c1cnc(Cl)cc1Cl.CNC(=O)c1cnc(Cl)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1S(C)(=O)=O.CSc1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.Nc1ccc(F)cn1.[Li+]
InChIInChI=1S/C18H17FN6O3S.C18H17FN6O.C13H13ClN4O.C7H6Cl2N2O.C6H8N2S.C6H18NSi2.C5H5FN2.Li/c1-20-18(26)12-10-23-16(25-15-6-5-11(19)9-22-15)8-13(12)24-17-14(29(2,27)28)4-3-7-21-17;1-11-4-3-7-21-17(11)24-14-8-16(23-10-13(14)18(26)20-2)25-15-6-5-12(19)9-22-15;1-8-4-3-5-16-12(8)18-10-6-11(14)17-7-9(10)13(19)15-2;1-10-7(12)4-3-11-6(9)2-5(4)8;1-9-5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;6-4-1-2-5(7)8-3-4;/h3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-7H,1-2H3,(H,15,19)(H,16,17,18);2-3H,1H3,(H,10,12);2-4H,1H3,(H2,7,8);1-6H3;1-3H,(H2,7,8);/q;;;;;-1;;+1
InChIKeyFTROJONYIIVTKF-UHFFFAOYSA-N
XLogP11.94
TPSA418.62 Ų
H-Bond Donors11
H-Bond Acceptors25
Rotatable Bonds18
Heavy Atoms113
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001670.23
LogP ≤ 511.94
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine?
The IUPAC name of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine (CID 158138843) is lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine.
What is the SMILES notation for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine?
The canonical SMILES for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine is CNC(=O)c1cnc(Cl)cc1Cl.CNC(=O)c1cnc(Cl)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1C.CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ncccc1S(C)(=O)=O.CSc1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.Nc1ccc(F)cn1.[Li+].
What is the InChIKey of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine?
The InChIKey is FTROJONYIIVTKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN6O3S.C18H17FN6O.C13H13ClN4O.C7H6Cl2N2O.C6H8N2S.C6H18NSi2.C5H5FN2.Li/c1-20-18(26)12-10-23-16(25-15-6-5-11(19)9-22-15)8-13(12)24-17-14(29(2,27)28)4-3-7-21-17;1-11-4-3-7-21-17(11)24-14-8-16(23-10-13(14)18(26)20-2)25-15-6-5-12(19)9-22-15;1-8-4-3-5-16-12(8)18-10-6-11(14)17-7-9(10)13(19)15-2;1-10-7(12)4-3-11-6(9)2-5(4)8;1-9-5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;6-4-1-2-5(7)8-3-4;/h3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-10H,1-2H3,(H,20,26)(H2,21,22,23,24,25);3-7H,1-2H3,(H,15,19)(H,16,17,18);2-3H,1H3,(H,10,12);2-4H,1H3,(H2,7,8);1-6H3;1-3H,(H2,7,8);/q;;;;;-1;;+1.
What are the key properties of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine?
lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine has a molecular weight of 1670.23 g/mol, XLogP of 11.94, 18 rotatable bonds, 11 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;4,6-dichloro-N-methylpyridine-3-carboxamide;5-fluoropyridin-2-amine;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methyl-2-pyridinyl)amino]pyridine-3-carboxamide;6-[(5-fluoro-2-pyridinyl)amino]-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridine-3-carboxamide;3-methylsulfanylpyridin-2-amine is sourced from PubChem (CID 158138843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).