7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine

C41H45N11O3 — CID 160933417

About 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine

7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine (PubChem CID 160933417) has the molecular formula C41H45N11O3 and a molecular weight of 739.89 g/mol. Its IUPAC name is 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine.

Molecular Properties

• Compound Name: 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine
• PubChem CID: 160933417
• Molecular Formula: C41H45N11O3
• Molecular Weight: 739.89 g/mol
• Exact Mass: 739.37
• IUPAC Name: 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine
• SMILES: Cc1cc(C(C)Cc2ccccc2)c2nc(N3CCOCC3)cc(=O)n2c1.Nc1ncc(-c2nc(N3CCOCC3)nc3c2CCN3c2ccncc2)cn1
• InChI: InChI=1S/C22H25N3O2.C19H20N8O/c1-16-12-19(17(2)13-18-6-4-3-5-7-18)22-23-20(14-21(26)25(22)15-16)24-8-10-27-11-9-24;20-18-22-11-13(12-23-18)16-15-3-6-27(14-1-4-21-5-2-14)17(15)25-19(24-16)26-7-9-28-10-8-26/h3-7,12,14-15,17H,8-11,13H2,1-2H3;1-2,4-5,11-12H,3,6-10H2,(H2,20,22,23)
• InChIKey: STOGXRZHMQMWIQ-UHFFFAOYSA-N
• XLogP: 4.63
• TPSA: 153.02 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 7
• Heavy Atoms: 55
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	739.89
LogP ≤ 5	4.63
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine?

The IUPAC name of 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine (CID 160933417) is 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine.

What is the SMILES notation for 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine?

The canonical SMILES for 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine is Cc1cc(C(C)Cc2ccccc2)c2nc(N3CCOCC3)cc(=O)n2c1.Nc1ncc(-c2nc(N3CCOCC3)nc3c2CCN3c2ccncc2)cn1.

What is the InChIKey of 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine?

The InChIKey is STOGXRZHMQMWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2.C19H20N8O/c1-16-12-19(17(2)13-18-6-4-3-5-7-18)22-23-20(14-21(26)25(22)15-16)24-8-10-27-11-9-24;20-18-22-11-13(12-23-18)16-15-3-6-27(14-1-4-21-5-2-14)17(15)25-19(24-16)26-7-9-28-10-8-26/h3-7,12,14-15,17H,8-11,13H2,1-2H3;1-2,4-5,11-12H,3,6-10H2,(H2,20,22,23).

What are the key properties of 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine?

7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine has a molecular weight of 739.89 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 7-methyl-2-morpholin-4-yl-9-(1-phenylpropan-2-yl)pyrido[1,2-a]pyrimidin-4-one;5-(2-morpholin-4-yl-7-pyridin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 160933417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).