N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate

C97H94N16O15 — CID 158378999

About N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate

N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate (PubChem CID 158378999) has the molecular formula C97H94N16O15 and a molecular weight of 1723.92 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate.

Molecular Properties

• Compound Name: N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate
• PubChem CID: 158378999
• Molecular Formula: C97H94N16O15
• Molecular Weight: 1723.92 g/mol
• Exact Mass: 1722.71
• IUPAC Name: N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate
• SMILES: CC(=O)Cc1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.CC(=O)c1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.CCOC(=O)c1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.COC(=O)Cc1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.Cc1cc(C)n2ccc(C(=O)Nc3cccc(CC(=O)ON4C(=O)CCC4=O)c3)c2n1
• InChI: InChI=1S/C22H20N4O5.2C19H19N3O3.C19H19N3O2.C18H17N3O2/c1-13-10-14(2)25-9-8-17(21(25)23-13)22(30)24-16-5-3-4-15(11-16)12-20(29)31-26-18(27)6-7-19(26)28;1-12-9-13(2)22-8-7-16(18(22)20-12)19(24)21-15-6-4-5-14(10-15)11-17(23)25-3;1-4-25-19(24)14-6-5-7-15(11-14)21-18(23)16-8-9-22-13(3)10-12(2)20-17(16)22;1-12-9-13(2)22-8-7-17(18(22)20-12)19(24)21-16-6-4-5-15(11-16)10-14(3)23;1-11-9-12(2)21-8-7-16(17(21)19-11)18(23)20-15-6-4-5-14(10-15)13(3)22/h3-5,8-11H,6-7,12H2,1-2H3,(H,24,30);4-10H,11H2,1-3H3,(H,21,24);5-11H,4H2,1-3H3,(H,21,23);4-9,11H,10H2,1-3H3,(H,21,24);4-10H,1-3H3,(H,20,23)
• InChIKey: GVOBFQFNMLTNGF-UHFFFAOYSA-N
• XLogP: 15.39
• TPSA: 382.42 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1723.92
LogP ≤ 5	15.39
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate?

The IUPAC name of N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate (CID 158378999) is N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate.

What is the SMILES notation for N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate?

The canonical SMILES for N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate is CC(=O)Cc1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.CC(=O)c1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.CCOC(=O)c1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.COC(=O)Cc1cccc(NC(=O)c2ccn3c(C)cc(C)nc23)c1.Cc1cc(C)n2ccc(C(=O)Nc3cccc(CC(=O)ON4C(=O)CCC4=O)c3)c2n1.

What is the InChIKey of N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate?

The InChIKey is GVOBFQFNMLTNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O5.2C19H19N3O3.C19H19N3O2.C18H17N3O2/c1-13-10-14(2)25-9-8-17(21(25)23-13)22(30)24-16-5-3-4-15(11-16)12-20(29)31-26-18(27)6-7-19(26)28;1-12-9-13(2)22-8-7-16(18(22)20-12)19(24)21-15-6-4-5-14(10-15)11-17(23)25-3;1-4-25-19(24)14-6-5-7-15(11-14)21-18(23)16-8-9-22-13(3)10-12(2)20-17(16)22;1-12-9-13(2)22-8-7-17(18(22)20-12)19(24)21-16-6-4-5-15(11-16)10-14(3)23;1-11-9-12(2)21-8-7-16(17(21)19-11)18(23)20-15-6-4-5-14(10-15)13(3)22/h3-5,8-11H,6-7,12H2,1-2H3,(H,24,30);4-10H,11H2,1-3H3,(H,21,24);5-11H,4H2,1-3H3,(H,21,23);4-9,11H,10H2,1-3H3,(H,21,24);4-10H,1-3H3,(H,20,23).

What are the key properties of N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate?

N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate has a molecular weight of 1723.92 g/mol, XLogP of 15.39, 20 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-acetylphenyl)-2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carboxamide;2,4-dimethyl-N-[3-(2-oxopropyl)phenyl]pyrrolo[1,2-a]pyrimidine-8-carboxamide;(2,5-dioxopyrrolidin-1-yl) 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate;ethyl 3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]benzoate;methyl 2-[3-[(2,4-dimethylpyrrolo[1,2-a]pyrimidine-8-carbonyl)amino]phenyl]acetate is sourced from PubChem (CID 158378999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).