6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine

C157H174N28O2S4 — CID 158487738

About 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine

6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine (PubChem CID 158487738) has the molecular formula C157H174N28O2S4 and a molecular weight of 2613.58 g/mol. Its IUPAC name is 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine.

Molecular Properties

• Compound Name: 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine
• PubChem CID: 158487738
• Molecular Formula: C157H174N28O2S4
• Molecular Weight: 2613.58 g/mol
• Exact Mass: 2611.33
• IUPAC Name: 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine
• SMILES: CNCc1ccccc1-c1ccc(C(C)Nc2nncc3ccc(N4CCOCC4)cc23)s1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3cc(C)c(C)cc23)c1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3ccc(N(C)C)cc23)c1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3ccccc23)c1.Cc1cc2cnnc(N[C@H](C)c3cccc(C)c3C)c2cc1C.Cc1cccc([C@@H](C)Nc2nncc3cc(C)c(C)cc23)c1.Cc1cccc([C@@H](C)Nc2nncc3ccc(N4CC[C@H](O)C4)cc23)c1C
• InChI: InChI=1S/C26H29N5OS.C24H27N5S.C24H26N4S.C22H26N4O.C22H22N4S.C20H23N3.C19H21N3/c1-18(24-9-10-25(33-24)22-6-4-3-5-19(22)16-27-2)29-26-23-15-21(31-11-13-32-14-12-31)8-7-20(23)17-28-30-26;1-16(23-11-19(15-30-23)21-8-6-5-7-17(21)13-25-2)27-24-22-12-20(29(3)4)10-9-18(22)14-26-28-24;1-15-9-19-13-26-28-24(22(19)10-16(15)2)27-17(3)23-11-20(14-29-23)21-8-6-5-7-18(21)12-25-4;1-14-5-4-6-20(15(14)2)16(3)24-22-21-11-18(26-10-9-19(27)13-26)8-7-17(21)12-23-25-22;1-15(25-22-20-10-6-4-8-17(20)13-24-26-22)21-11-18(14-27-21)19-9-5-3-7-16(19)12-23-2;1-12-7-6-8-18(15(12)4)16(5)22-20-19-10-14(3)13(2)9-17(19)11-21-23-20;1-12-6-5-7-16(8-12)15(4)21-19-18-10-14(3)13(2)9-17(18)11-20-22-19/h3-10,15,17-18,27H,11-14,16H2,1-2H3,(H,29,30);5-12,14-16,25H,13H2,1-4H3,(H,27,28);5-11,13-14,17,25H,12H2,1-4H3,(H,27,28);4-8,11-12,16,19,27H,9-10,13H2,1-3H3,(H,24,25);3-11,13-15,23H,12H2,1-2H3,(H,25,26);6-11,16H,1-5H3,(H,22,23);5-11,15H,1-4H3,(H,21,22)/t;16-;17-;16-,19+;15-;16-;15-/m.111111/s1
• InChIKey: HIHSIUDHPDTIJT-JETUSWDESA-N
• XLogP: 35.28
• TPSA: 351.97 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 34
• Rotatable Bonds: 36
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2613.58
LogP ≤ 5	35.28
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine?

The IUPAC name of 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine (CID 158487738) is 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine.

What is the SMILES notation for 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine?

The canonical SMILES for 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine is CNCc1ccccc1-c1ccc(C(C)Nc2nncc3ccc(N4CCOCC4)cc23)s1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3cc(C)c(C)cc23)c1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3ccc(N(C)C)cc23)c1.CNCc1ccccc1-c1csc([C@@H](C)Nc2nncc3ccccc23)c1.Cc1cc2cnnc(N[C@H](C)c3cccc(C)c3C)c2cc1C.Cc1cccc([C@@H](C)Nc2nncc3cc(C)c(C)cc23)c1.Cc1cccc([C@@H](C)Nc2nncc3ccc(N4CC[C@H](O)C4)cc23)c1C.

What is the InChIKey of 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine?

The InChIKey is HIHSIUDHPDTIJT-JETUSWDESA-N. The full InChI is InChI=1S/C26H29N5OS.C24H27N5S.C24H26N4S.C22H26N4O.C22H22N4S.C20H23N3.C19H21N3/c1-18(24-9-10-25(33-24)22-6-4-3-5-19(22)16-27-2)29-26-23-15-21(31-11-13-32-14-12-31)8-7-20(23)17-28-30-26;1-16(23-11-19(15-30-23)21-8-6-5-7-17(21)13-25-2)27-24-22-12-20(29(3)4)10-9-18(22)14-26-28-24;1-15-9-19-13-26-28-24(22(19)10-16(15)2)27-17(3)23-11-20(14-29-23)21-8-6-5-7-18(21)12-25-4;1-14-5-4-6-20(15(14)2)16(3)24-22-21-11-18(26-10-9-19(27)13-26)8-7-17(21)12-23-25-22;1-15(25-22-20-10-6-4-8-17(20)13-24-26-22)21-11-18(14-27-21)19-9-5-3-7-16(19)12-23-2;1-12-7-6-8-18(15(12)4)16(5)22-20-19-10-14(3)13(2)9-17(19)11-21-23-20;1-12-6-5-7-16(8-12)15(4)21-19-18-10-14(3)13(2)9-17(18)11-20-22-19/h3-10,15,17-18,27H,11-14,16H2,1-2H3,(H,29,30);5-12,14-16,25H,13H2,1-4H3,(H,27,28);5-11,13-14,17,25H,12H2,1-4H3,(H,27,28);4-8,11-12,16,19,27H,9-10,13H2,1-3H3,(H,24,25);3-11,13-15,23H,12H2,1-2H3,(H,25,26);6-11,16H,1-5H3,(H,22,23);5-11,15H,1-4H3,(H,21,22)/t;16-;17-;16-,19+;15-;16-;15-/m.111111/s1.

What are the key properties of 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine?

6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine has a molecular weight of 2613.58 g/mol, XLogP of 35.28, 36 rotatable bonds, 12 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 6,7-dimethyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine;7-N,7-N-dimethyl-1-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazine-1,7-diamine;6,7-dimethyl-N-[(1R)-1-(3-methylphenyl)ethyl]phthalazin-1-amine;(3S)-1-[4-[[(1R)-1-(2,3-dimethylphenyl)ethyl]amino]phthalazin-6-yl]pyrrolidin-3-ol;N-[(1R)-1-(2,3-dimethylphenyl)ethyl]-6,7-dimethylphthalazin-1-amine;N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]-7-morpholin-4-ylphthalazin-1-amine;N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]phthalazin-1-amine is sourced from PubChem (CID 158487738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).