7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane

C141H157N23O13 — CID 157445782

About 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane

7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane (PubChem CID 157445782) has the molecular formula C141H157N23O13 and a molecular weight of 2381.95 g/mol. Its IUPAC name is 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane.

Molecular Properties

• Compound Name: 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane
• PubChem CID: 157445782
• Molecular Formula: C141H157N23O13
• Molecular Weight: 2381.95 g/mol
• Exact Mass: 2380.23
• IUPAC Name: 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane
• SMILES: C.C.CC(C)Cn1c(=O)n(C)c(=O)c2cn(Cc3ccc(-c4ccccn4)cc3)c(N3C(=O)CCC3=O)c21.CCc1ccc(Cn2cc3c(c2Nc2ccccc2)c(=O)n(C)c(=O)n3CC(C)C)cc1.COc1ccc(Cn2cc3c(=O)n(C)c(=O)n(CC(C)C)c3c2Nc2ccccc2)cc1.Cc1cccc(-c2ccc(Cn3cc4c(=O)n(C)c(=O)n(CC(C)(C)C)c4c3Nc3ccccc3)cc2)n1.Cc1cccc(-c2ccc(Cn3cc4c(=O)n(C)c(=O)n(CC(C)C)c4c3Nc3ccccc3)cc2)n1
• InChI: InChI=1S/C31H33N5O2.C30H31N5O2.C27H27N5O4.C26H30N4O2.C25H28N4O3.2CH4/c1-21-10-9-13-26(32-21)23-16-14-22(15-17-23)18-35-19-25-27(28(35)33-24-11-7-6-8-12-24)36(20-31(2,3)4)30(38)34(5)29(25)37;1-20(2)17-35-27-25(29(36)33(4)30(35)37)19-34(28(27)32-24-10-6-5-7-11-24)18-22-13-15-23(16-14-22)26-12-8-9-21(3)31-26;1-17(2)14-31-24-20(26(35)29(3)27(31)36)16-30(25(24)32-22(33)11-12-23(32)34)15-18-7-9-19(10-8-18)21-6-4-5-13-28-21;1-5-19-11-13-20(14-12-19)16-29-17-22-23(24(29)27-21-9-7-6-8-10-21)25(31)28(4)26(32)30(22)15-18(2)3;1-17(2)14-29-22-21(24(30)27(3)25(29)31)16-28(15-18-10-12-20(32-4)13-11-18)23(22)26-19-8-6-5-7-9-19;;/h6-17,19,33H,18,20H2,1-5H3;5-16,19-20,32H,17-18H2,1-4H3;4-10,13,16-17H,11-12,14-15H2,1-3H3;6-14,17-18,27H,5,15-16H2,1-4H3;5-13,16-17,26H,14-15H2,1-4H3;2*1H4
• InChIKey: BSEZMHIMJCHYJE-UHFFFAOYSA-N
• XLogP: 23.69
• TPSA: 378.05 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 35
• Rotatable Bonds: 33
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2381.95
LogP ≤ 5	23.69
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane?

The IUPAC name of 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane (CID 157445782) is 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane.

What is the SMILES notation for 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane?

The canonical SMILES for 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane is C.C.CC(C)Cn1c(=O)n(C)c(=O)c2cn(Cc3ccc(-c4ccccn4)cc3)c(N3C(=O)CCC3=O)c21.CCc1ccc(Cn2cc3c(c2Nc2ccccc2)c(=O)n(C)c(=O)n3CC(C)C)cc1.COc1ccc(Cn2cc3c(=O)n(C)c(=O)n(CC(C)C)c3c2Nc2ccccc2)cc1.Cc1cccc(-c2ccc(Cn3cc4c(=O)n(C)c(=O)n(CC(C)(C)C)c4c3Nc3ccccc3)cc2)n1.Cc1cccc(-c2ccc(Cn3cc4c(=O)n(C)c(=O)n(CC(C)C)c4c3Nc3ccccc3)cc2)n1.

What is the InChIKey of 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane?

The InChIKey is BSEZMHIMJCHYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33N5O2.C30H31N5O2.C27H27N5O4.C26H30N4O2.C25H28N4O3.2CH4/c1-21-10-9-13-26(32-21)23-16-14-22(15-17-23)18-35-19-25-27(28(35)33-24-11-7-6-8-12-24)36(20-31(2,3)4)30(38)34(5)29(25)37;1-20(2)17-35-27-25(29(36)33(4)30(35)37)19-34(28(27)32-24-10-6-5-7-11-24)18-22-13-15-23(16-14-22)26-12-8-9-21(3)31-26;1-17(2)14-31-24-20(26(35)29(3)27(31)36)16-30(25(24)32-22(33)11-12-23(32)34)15-18-7-9-19(10-8-18)21-6-4-5-13-28-21;1-5-19-11-13-20(14-12-19)16-29-17-22-23(24(29)27-21-9-7-6-8-10-21)25(31)28(4)26(32)30(22)15-18(2)3;1-17(2)14-29-22-21(24(30)27(3)25(29)31)16-28(15-18-10-12-20(32-4)13-11-18)23(22)26-19-8-6-5-7-9-19;;/h6-17,19,33H,18,20H2,1-5H3;5-16,19-20,32H,17-18H2,1-4H3;4-10,13,16-17H,11-12,14-15H2,1-3H3;6-14,17-18,27H,5,15-16H2,1-4H3;5-13,16-17,26H,14-15H2,1-4H3;2*1H4.

What are the key properties of 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane?

7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane has a molecular weight of 2381.95 g/mol, XLogP of 23.69, 33 rotatable bonds, 4 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 7-anilino-1-(2,2-dimethylpropyl)-3-methyl-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;5-anilino-6-[(4-ethylphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-6-[(4-methoxyphenyl)methyl]-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione;7-anilino-3-methyl-1-(2-methylpropyl)-6-[[4-(6-methyl-2-pyridinyl)phenyl]methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;7-(2,5-dioxopyrrolidin-1-yl)-3-methyl-1-(2-methylpropyl)-6-[(4-pyridin-2-ylphenyl)methyl]pyrrolo[3,4-d]pyrimidine-2,4-dione;methane is sourced from PubChem (CID 157445782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).