4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide

C117H156N24O10 — CID 157415375

About 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide

4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide (PubChem CID 157415375) has the molecular formula C117H156N24O10 and a molecular weight of 2058.69 g/mol. Its IUPAC name is 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide.

Molecular Properties

• Compound Name: 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide
• PubChem CID: 157415375
• Molecular Formula: C117H156N24O10
• Molecular Weight: 2058.69 g/mol
• Exact Mass: 2057.24
• IUPAC Name: 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide
• SMILES: C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CCC.CN(C)CCOc1nc(N)c2c(n1)CN(c1cc(O)cc3ccccc13)CC2.Nc1nc(N2CCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2.Nc1nc(N2CCCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2.Nc1nc(OCCN2CCCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2
• InChI: InChI=1S/C24H29N5O2.C22H25N5O.C21H25N5O2.C21H23N5O.C8H15NO.3C7H13NO/c25-23-20-8-11-29(22-15-18(30)14-17-6-2-3-7-19(17)22)16-21(20)26-24(27-23)31-13-12-28-9-4-1-5-10-28;23-21-18-8-11-27(20-13-16(28)12-15-6-2-3-7-17(15)20)14-19(18)24-22(25-21)26-9-4-1-5-10-26;1-25(2)9-10-28-21-23-18-13-26(8-7-17(18)20(22)24-21)19-12-15(27)11-14-5-3-4-6-16(14)19;22-20-17-7-10-26(13-18(17)23-21(24-20)25-8-3-4-9-25)19-12-15(27)11-14-5-1-2-6-16(14)19;1-4-7-9(6-3)8(10)5-2;3*1-4-7(9)8(5-2)6-3/h2-3,6-7,14-15,30H,1,4-5,8-13,16H2,(H2,25,26,27);2-3,6-7,12-13,28H,1,4-5,8-11,14H2,(H2,23,24,25);3-6,11-12,27H,7-10,13H2,1-2H3,(H2,22,23,24);1-2,5-6,11-12,27H,3-4,7-10,13H2,(H2,22,23,24);5H,2,4,6-7H2,1,3H3;3*4H,1,5-6H2,2-3H3
• InChIKey: BOTZRLFRXSFCPM-UHFFFAOYSA-N
• XLogP: 16.87
• TPSA: 413.74 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 30
• Rotatable Bonds: 27
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2058.69
LogP ≤ 5	16.87
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide?

The IUPAC name of 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide (CID 157415375) is 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide.

What is the SMILES notation for 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide?

The canonical SMILES for 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide is C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CC.C=CC(=O)N(CC)CCC.CN(C)CCOc1nc(N)c2c(n1)CN(c1cc(O)cc3ccccc13)CC2.Nc1nc(N2CCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2.Nc1nc(N2CCCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2.Nc1nc(OCCN2CCCCC2)nc2c1CCN(c1cc(O)cc3ccccc13)C2.

What is the InChIKey of 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide?

The InChIKey is BOTZRLFRXSFCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O2.C22H25N5O.C21H25N5O2.C21H23N5O.C8H15NO.3C7H13NO/c25-23-20-8-11-29(22-15-18(30)14-17-6-2-3-7-19(17)22)16-21(20)26-24(27-23)31-13-12-28-9-4-1-5-10-28;23-21-18-8-11-27(20-13-16(28)12-15-6-2-3-7-17(15)20)14-19(18)24-22(25-21)26-9-4-1-5-10-26;1-25(2)9-10-28-21-23-18-13-26(8-7-17(18)20(22)24-21)19-12-15(27)11-14-5-3-4-6-16(14)19;22-20-17-7-10-26(13-18(17)23-21(24-20)25-8-3-4-9-25)19-12-15(27)11-14-5-1-2-6-16(14)19;1-4-7-9(6-3)8(10)5-2;3*1-4-7(9)8(5-2)6-3/h2-3,6-7,14-15,30H,1,4-5,8-13,16H2,(H2,25,26,27);2-3,6-7,12-13,28H,1,4-5,8-11,14H2,(H2,23,24,25);3-6,11-12,27H,7-10,13H2,1-2H3,(H2,22,23,24);1-2,5-6,11-12,27H,3-4,7-10,13H2,(H2,22,23,24);5H,2,4,6-7H2,1,3H3;3*4H,1,5-6H2,2-3H3.

What are the key properties of 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide?

4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide has a molecular weight of 2058.69 g/mol, XLogP of 16.87, 27 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-amino-2-[2-(dimethylamino)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;4-[4-amino-2-(2-piperidin-1-ylethoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]naphthalen-2-ol;4-(4-amino-2-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)naphthalen-2-ol;tris(N,N-diethylprop-2-enamide);N-ethyl-N-propylprop-2-enamide is sourced from PubChem (CID 157415375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).