lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine

C51H72Cl3LiN18O11S3Si2 — CID 158209116

IUPAClithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine
SMILESC.CNC(=O)c1nnc(Cl)cc1Cl.CNC(=O)c1nnc(Cl)cc1Nc1ncccc1S(C)(=O)=O.CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1ncccc1S(C)(=O)=O.CS(=O)(=O)c1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.NC(=O)C1CC1.[Li+]
InChIInChI=1S/C16H18N6O4S.C12H12ClN5O3S.C6H5Cl2N3O.C6H8N2O2S.C6H18NSi2.C4H7NO.CH4.Li/c1-17-16(24)13-10(8-12(21-22-13)20-15(23)9-5-6-9)19-14-11(27(2,25)26)4-3-7-18-14;1-14-12(19)10-7(6-9(13)17-18-10)16-11-8(22(2,20)21)4-3-5-15-11;1-9-6(12)5-3(7)2-4(8)10-11-5;1-11(9,10)5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;5-4(6)3-1-2-3;;/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,19,20,21,23);3-6H,1-2H3,(H,14,19)(H,15,16,17);2H,1H3,(H,9,12);2-4H,1H3,(H2,7,8);1-6H3;3H,1-2H2,(H2,5,6);1H4;/q;;;;-1;;;+1
InChIKeyGBVVGXJCFWZWAR-UHFFFAOYSA-N
MW1378.92 g/mol
LogP3.52
Rot. Bonds15

About lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine

lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine (PubChem CID 158209116) has the molecular formula C51H72Cl3LiN18O11S3Si2 and a molecular weight of 1378.92 g/mol. Its IUPAC name is lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine.

Molecular Properties

Compound Namelithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine
PubChem CID158209116
Molecular FormulaC51H72Cl3LiN18O11S3Si2
Molecular Weight1378.92 g/mol
Exact Mass1376.36
IUPAC Namelithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine
SMILESC.CNC(=O)c1nnc(Cl)cc1Cl.CNC(=O)c1nnc(Cl)cc1Nc1ncccc1S(C)(=O)=O.CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1ncccc1S(C)(=O)=O.CS(=O)(=O)c1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.NC(=O)C1CC1.[Li+]
InChIInChI=1S/C16H18N6O4S.C12H12ClN5O3S.C6H5Cl2N3O.C6H8N2O2S.C6H18NSi2.C4H7NO.CH4.Li/c1-17-16(24)13-10(8-12(21-22-13)20-15(23)9-5-6-9)19-14-11(27(2,25)26)4-3-7-18-14;1-14-12(19)10-7(6-9(13)17-18-10)16-11-8(22(2,20)21)4-3-5-15-11;1-9-6(12)5-3(7)2-4(8)10-11-5;1-11(9,10)5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;5-4(6)3-1-2-3;;/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,19,20,21,23);3-6H,1-2H3,(H,14,19)(H,15,16,17);2H,1H3,(H,9,12);2-4H,1H3,(H2,7,8);1-6H3;3H,1-2H2,(H2,5,6);1H4;/q;;;;-1;;;+1
InChIKeyGBVVGXJCFWZWAR-UHFFFAOYSA-N
XLogP3.52
TPSA442.10 Ų
H-Bond Donors8
H-Bond Acceptors23
Rotatable Bonds15
Heavy Atoms89
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001378.92
LogP ≤ 53.52
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-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-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine?
The IUPAC name of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine (CID 158209116) is lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine.
What is the SMILES notation for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine?
The canonical SMILES for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine is C.CNC(=O)c1nnc(Cl)cc1Cl.CNC(=O)c1nnc(Cl)cc1Nc1ncccc1S(C)(=O)=O.CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1ncccc1S(C)(=O)=O.CS(=O)(=O)c1cccnc1N.C[Si](C)(C)[N-][Si](C)(C)C.NC(=O)C1CC1.[Li+].
What is the InChIKey of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine?
The InChIKey is GBVVGXJCFWZWAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O4S.C12H12ClN5O3S.C6H5Cl2N3O.C6H8N2O2S.C6H18NSi2.C4H7NO.CH4.Li/c1-17-16(24)13-10(8-12(21-22-13)20-15(23)9-5-6-9)19-14-11(27(2,25)26)4-3-7-18-14;1-14-12(19)10-7(6-9(13)17-18-10)16-11-8(22(2,20)21)4-3-5-15-11;1-9-6(12)5-3(7)2-4(8)10-11-5;1-11(9,10)5-3-2-4-8-6(5)7;1-8(2,3)7-9(4,5)6;5-4(6)3-1-2-3;;/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,19,20,21,23);3-6H,1-2H3,(H,14,19)(H,15,16,17);2H,1H3,(H,9,12);2-4H,1H3,(H2,7,8);1-6H3;3H,1-2H2,(H2,5,6);1H4;/q;;;;-1;;;+1.
What are the key properties of lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine?
lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine has a molecular weight of 1378.92 g/mol, XLogP of 3.52, 15 rotatable bonds, 8 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;bis(trimethylsilyl)azanide;6-chloro-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;6-(cyclopropanecarbonylamino)-N-methyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]pyridazine-3-carboxamide;cyclopropanecarboxamide;4,6-dichloro-N-methylpyridazine-3-carboxamide;methane;3-methylsulfonylpyridin-2-amine is sourced from PubChem (CID 158209116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).