5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone

C112H117FN32O8S6 — CID 160859034

About 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone

5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone (PubChem CID 160859034) has the molecular formula C112H117FN32O8S6 and a molecular weight of 2250.78 g/mol. Its IUPAC name is 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone.

Molecular Properties

• Compound Name: 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone
• PubChem CID: 160859034
• Molecular Formula: C112H117FN32O8S6
• Molecular Weight: 2250.78 g/mol
• Exact Mass: 2248.80
• IUPAC Name: 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone
• SMILES: COc1ccc(CNC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1ccc2c(c1)CCN(C(=O)c1sc3nnc(C)c(C)c3c1N)C2.Cc1nnc2sc(C(=O)N3CC(F)(c4cccc(-c5cncnc5)c4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CC(NCc4cccnc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CC(NCc4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccnc3)c(N)c2c1C
• InChI: InChI=1S/C22H19FN6OS.C20H23N5O2S.C19H20N4O2S.2C18H20N6OS.C15H15N5OS/c1-12-13(2)27-28-20-17(12)18(24)19(31-20)21(30)29-9-22(23,10-29)16-5-3-4-14(6-16)15-7-25-11-26-8-15;1-11-12(2)23-24-19-16(11)17(21)18(28-19)20(26)25-9-14(10-25)22-8-13-4-6-15(27-3)7-5-13;1-10-11(2)21-22-18-15(10)16(20)17(26-18)19(24)23-7-6-12-8-14(25-3)5-4-13(12)9-23;1-10-11(2)22-23-17-14(10)15(19)16(26-17)18(25)24-8-13(9-24)21-7-12-3-5-20-6-4-12;1-10-11(2)22-23-17-14(10)15(19)16(26-17)18(25)24-8-13(9-24)21-7-12-4-3-5-20-6-12;1-8-9(2)19-20-15-11(8)12(16)13(22-15)14(21)18-7-10-4-3-5-17-6-10/h3-8,11H,9-10,24H2,1-2H3;4-7,14,22H,8-10,21H2,1-3H3;4-5,8H,6-7,9,20H2,1-3H3;2*3-6,13,21H,7-9,19H2,1-2H3;3-6H,7,16H2,1-2H3,(H,18,21)
• InChIKey: SKFXLJXSFCXSEU-UHFFFAOYSA-N
• XLogP: 15.29
• TPSA: 560.45 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 40
• Rotatable Bonds: 21
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2250.78
LogP ≤ 5	15.29
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone?

The IUPAC name of 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone (CID 160859034) is 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone.

What is the SMILES notation for 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone?

The canonical SMILES for 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone is COc1ccc(CNC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1ccc2c(c1)CCN(C(=O)c1sc3nnc(C)c(C)c3c1N)C2.Cc1nnc2sc(C(=O)N3CC(F)(c4cccc(-c5cncnc5)c4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CC(NCc4cccnc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CC(NCc4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccnc3)c(N)c2c1C.

What is the InChIKey of 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone?

The InChIKey is SKFXLJXSFCXSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN6OS.C20H23N5O2S.C19H20N4O2S.2C18H20N6OS.C15H15N5OS/c1-12-13(2)27-28-20-17(12)18(24)19(31-20)21(30)29-9-22(23,10-29)16-5-3-4-14(6-16)15-7-25-11-26-8-15;1-11-12(2)23-24-19-16(11)17(21)18(28-19)20(26)25-9-14(10-25)22-8-13-4-6-15(27-3)7-5-13;1-10-11(2)21-22-18-15(10)16(20)17(26-18)19(24)23-7-6-12-8-14(25-3)5-4-13(12)9-23;1-10-11(2)22-23-17-14(10)15(19)16(26-17)18(25)24-8-13(9-24)21-7-12-3-5-20-6-4-12;1-10-11(2)22-23-17-14(10)15(19)16(26-17)18(25)24-8-13(9-24)21-7-12-4-3-5-20-6-12;1-8-9(2)19-20-15-11(8)12(16)13(22-15)14(21)18-7-10-4-3-5-17-6-10/h3-8,11H,9-10,24H2,1-2H3;4-7,14,22H,8-10,21H2,1-3H3;4-5,8H,6-7,9,20H2,1-3H3;2*3-6,13,21H,7-9,19H2,1-2H3;3-6H,7,16H2,1-2H3,(H,18,21).

What are the key properties of 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone?

5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone has a molecular weight of 2250.78 g/mol, XLogP of 15.29, 21 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-3,4-dimethyl-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-pyrimidin-5-ylphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-[(4-methoxyphenyl)methylamino]azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-3-ylmethylamino)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(pyridin-4-ylmethylamino)azetidin-1-yl]methanone is sourced from PubChem (CID 160859034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).