5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C126H133F2N31O10S6 — CID 159041836

About 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 159041836) has the molecular formula C126H133F2N31O10S6 and a molecular weight of 2472.05 g/mol. Its IUPAC name is 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 159041836
• Molecular Formula: C126H133F2N31O10S6
• Molecular Weight: 2472.05 g/mol
• Exact Mass: 2469.91
• IUPAC Name: 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: CCCCCC(=O)NC1CCN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.COc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c(F)c1.Cc1cc(C(=O)NC2CCN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)ccc1F.Cc1ccc(C(=O)N2CCC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1nnc2sc(C(=O)NCc3ccc(-c4cc(C)c5[nH]ncc5c4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4ccc5[nH]ncc5c4C)cc3)c(N)c2c1C
• InChI: InChI=1S/2C24H22N6OS.C21H22FN5O2S.C21H23N5O2S.C19H27N5O2S.C17H17FN4O2S/c1-12-8-17(9-18-11-27-29-21(12)18)16-6-4-15(5-7-16)10-26-23(31)22-20(25)19-13(2)14(3)28-30-24(19)32-22;1-12-14(3)28-30-24-20(12)21(25)22(32-24)23(31)26-10-15-4-6-16(7-5-15)17-8-9-19-18(13(17)2)11-27-29-19;1-10-8-13(4-5-15(10)22)19(28)24-14-6-7-27(9-14)21(29)18-17(23)16-11(2)12(3)25-26-20(16)30-18;1-11-4-6-14(7-5-11)21(28)26-9-8-15(10-26)23-19(27)18-17(22)16-12(2)13(3)24-25-20(16)29-18;1-4-5-6-7-14(25)21-13-8-9-24(10-13)19(26)17-16(20)15-11(2)12(3)22-23-18(15)27-17;1-8-9(2)21-22-17-13(8)14(19)15(25-17)16(23)20-7-10-4-5-11(24-3)6-12(10)18/h2*4-9,11H,10,25H2,1-3H3,(H,26,31)(H,27,29);4-5,8,14H,6-7,9,23H2,1-3H3,(H,24,28);4-7,15H,8-10,22H2,1-3H3,(H,23,27);13H,4-10,20H2,1-3H3,(H,21,25);4-6H,7,19H2,1-3H3,(H,20,23)
• InChIKey: JWDRAGXOLVPWNY-UHFFFAOYSA-N
• XLogP: 20.94
• TPSA: 612.92 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 36
• Rotatable Bonds: 24
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2472.05
LogP ≤ 5	20.94
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 159041836) is 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is CCCCCC(=O)NC1CCN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.COc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c(F)c1.Cc1cc(C(=O)NC2CCN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)ccc1F.Cc1ccc(C(=O)N2CCC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1nnc2sc(C(=O)NCc3ccc(-c4cc(C)c5[nH]ncc5c4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4ccc5[nH]ncc5c4C)cc3)c(N)c2c1C.

What is the InChIKey of 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is JWDRAGXOLVPWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H22N6OS.C21H22FN5O2S.C21H23N5O2S.C19H27N5O2S.C17H17FN4O2S/c1-12-8-17(9-18-11-27-29-21(12)18)16-6-4-15(5-7-16)10-26-23(31)22-20(25)19-13(2)14(3)28-30-24(19)32-22;1-12-14(3)28-30-24-20(12)21(25)22(32-24)23(31)26-10-15-4-6-16(7-5-15)17-8-9-19-18(13(17)2)11-27-29-19;1-10-8-13(4-5-15(10)22)19(28)24-14-6-7-27(9-14)21(29)18-17(23)16-11(2)12(3)25-26-20(16)30-18;1-11-4-6-14(7-5-11)21(28)26-9-8-15(10-26)23-19(27)18-17(22)16-12(2)13(3)24-25-20(16)29-18;1-4-5-6-7-14(25)21-13-8-9-24(10-13)19(26)17-16(20)15-11(2)12(3)22-23-18(15)27-17;1-8-9(2)21-22-17-13(8)14(19)15(25-17)16(23)20-7-10-4-5-11(24-3)6-12(10)18/h2*4-9,11H,10,25H2,1-3H3,(H,26,31)(H,27,29);4-5,8,14H,6-7,9,23H2,1-3H3,(H,24,28);4-7,15H,8-10,22H2,1-3H3,(H,23,27);13H,4-10,20H2,1-3H3,(H,21,25);4-6H,7,19H2,1-3H3,(H,20,23).

What are the key properties of 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2472.05 g/mol, XLogP of 20.94, 24 rotatable bonds, 14 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(4-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(7-methyl-1H-indazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-4-fluoro-3-methylbenzamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]hexanamide;5-amino-N-[(2-fluoro-4-methoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 159041836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).