8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one

C147H151N23O10 — CID 158343090

About 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one

8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 158343090) has the molecular formula C147H151N23O10 and a molecular weight of 2399.98 g/mol. Its IUPAC name is 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

• Compound Name: 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one
• PubChem CID: 158343090
• Molecular Formula: C147H151N23O10
• Molecular Weight: 2399.98 g/mol
• Exact Mass: 2398.20
• IUPAC Name: 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one
• SMILES: C=C(c1cc2cnc(Nc3ccc(N4CCNCC4)cc3)nc2n(C2C(=O)c3ccccc3NC2(C)C)c1=O)C1CCOCC1.C=C(c1ccccc1)c1cc2cnc(Nc3ccc(C4CCNCC4)cc3)nc2n(C2C(=O)c3ccccc3CC2(C)C)c1=O.CN1CCC(c2ccc(Nc3ncc4cc(N(C)c5ccccc5)c(=O)n(C5Cc6ccccc6C(=O)C5(C)C)c4n3)cc2)C1.Cc1ccccc1Oc1cc2cnc(Nc3ccc(C4CCCNC4)cc3)nc2n(C2C(=O)Cc3ccccc3C2(C)C)c1=O
• InChI: InChI=1S/C38H37N5O2.C37H38N6O2.C37H37N5O3.C35H39N7O3/c1-24(25-9-5-4-6-10-25)32-21-29-23-40-37(41-30-15-13-26(14-16-30)27-17-19-39-20-18-27)42-35(29)43(36(32)45)34-33(44)31-12-8-7-11-28(31)22-38(34,2)3;1-37(2)32(21-25-10-8-9-13-30(25)33(37)44)43-34-27(20-31(35(43)45)42(4)29-11-6-5-7-12-29)22-38-36(40-34)39-28-16-14-24(15-17-28)26-18-19-41(3)23-26;1-23-9-4-7-13-31(23)45-32-20-27-22-39-36(40-28-16-14-24(15-17-28)26-11-8-18-38-21-26)41-34(27)42(35(32)44)33-30(43)19-25-10-5-6-12-29(25)37(33,2)3;1-22(23-12-18-45-19-13-23)28-20-24-21-37-34(38-25-8-10-26(11-9-25)41-16-14-36-15-17-41)39-32(24)42(33(28)44)31-30(43)27-6-4-5-7-29(27)40-35(31,2)3/h4-16,21,23,27,34,39H,1,17-20,22H2,2-3H3,(H,40,41,42);5-17,20,22,26,32H,18-19,21,23H2,1-4H3,(H,38,39,40);4-7,9-10,12-17,20,22,26,33,38H,8,11,18-19,21H2,1-3H3,(H,39,40,41);4-11,20-21,23,31,36,40H,1,12-19H2,2-3H3,(H,37,38,39)
• InChIKey: GRJWMWCQXMKNAR-UHFFFAOYSA-N
• XLogP: 25.56
• TPSA: 383.82 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 33
• Rotatable Bonds: 24
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2399.98
LogP ≤ 5	25.56
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one?

The IUPAC name of 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one (CID 158343090) is 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one.

What is the SMILES notation for 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one?

The canonical SMILES for 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one is C=C(c1cc2cnc(Nc3ccc(N4CCNCC4)cc3)nc2n(C2C(=O)c3ccccc3NC2(C)C)c1=O)C1CCOCC1.C=C(c1ccccc1)c1cc2cnc(Nc3ccc(C4CCNCC4)cc3)nc2n(C2C(=O)c3ccccc3CC2(C)C)c1=O.CN1CCC(c2ccc(Nc3ncc4cc(N(C)c5ccccc5)c(=O)n(C5Cc6ccccc6C(=O)C5(C)C)c4n3)cc2)C1.Cc1ccccc1Oc1cc2cnc(Nc3ccc(C4CCCNC4)cc3)nc2n(C2C(=O)Cc3ccccc3C2(C)C)c1=O.

What is the InChIKey of 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one?

The InChIKey is GRJWMWCQXMKNAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H37N5O2.C37H38N6O2.C37H37N5O3.C35H39N7O3/c1-24(25-9-5-4-6-10-25)32-21-29-23-40-37(41-30-15-13-26(14-16-30)27-17-19-39-20-18-27)42-35(29)43(36(32)45)34-33(44)31-12-8-7-11-28(31)22-38(34,2)3;1-37(2)32(21-25-10-8-9-13-30(25)33(37)44)43-34-27(20-31(35(43)45)42(4)29-11-6-5-7-12-29)22-38-36(40-34)39-28-16-14-24(15-17-28)26-18-19-41(3)23-26;1-23-9-4-7-13-31(23)45-32-20-27-22-39-36(40-28-16-14-24(15-17-28)26-11-8-18-38-21-26)41-34(27)42(35(32)44)33-30(43)19-25-10-5-6-12-29(25)37(33,2)3;1-22(23-12-18-45-19-13-23)28-20-24-21-37-34(38-25-8-10-26(11-9-25)41-16-14-36-15-17-41)39-32(24)42(33(28)44)31-30(43)27-6-4-5-7-29(27)40-35(31,2)3/h4-16,21,23,27,34,39H,1,17-20,22H2,2-3H3,(H,40,41,42);5-17,20,22,26,32H,18-19,21,23H2,1-4H3,(H,38,39,40);4-7,9-10,12-17,20,22,26,33,38H,8,11,18-19,21H2,1-3H3,(H,39,40,41);4-11,20-21,23,31,36,40H,1,12-19H2,2-3H3,(H,37,38,39).

What are the key properties of 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one?

8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 2399.98 g/mol, XLogP of 25.56, 24 rotatable bonds, 8 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-2-yl)-6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-(1,1-dimethyl-3-oxo-2,4-dihydronaphthalen-2-yl)-6-(2-methylphenoxy)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(3,3-dimethyl-1-oxo-2,4-dihydronaphthalen-2-yl)-6-(1-phenylethenyl)-2-(4-piperidin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-(2,2-dimethyl-4-oxo-1,3-dihydroquinolin-3-yl)-6-[1-(oxan-4-yl)ethenyl]-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 158343090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).