1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one

C183H249N37O27 — CID 158602561

About 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one

1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one (PubChem CID 158602561) has the molecular formula C183H249N37O27 and a molecular weight of 3399.24 g/mol. Its IUPAC name is 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one.

Molecular Properties

• Compound Name: 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one
• PubChem CID: 158602561
• Molecular Formula: C183H249N37O27
• Molecular Weight: 3399.24 g/mol
• Exact Mass: 3396.92
• IUPAC Name: 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one
• SMILES: CC(C)CC(=O)Cc1cccnn1.CC(C)CC(=O)Cc1ccncn1.CC(C)CC(=O)Cc1ccnnc1.CC(C)CC(=O)Cc1cnc(=O)[nH]c1.CC(C)CC(=O)Cc1cnc[nH]c1=O.CC(C)CC(=O)Cc1cncnc1.CC(C)CC(=O)Cc1ncncc1C#N.COC(=O)c1cccnc1CC(=O)CC(C)C.COc1cc(CC(=O)CC(C)C)ncn1.COc1ccc(CC(=O)CC(C)C)nn1.COc1cnc(CC(=O)CC(C)C)cn1.COc1cncc(CC(=O)CC(C)C)n1.COc1cncnc1CC(=O)CC(C)C.COc1nccc(CC(=O)CC(C)C)n1.[C-]#[N+]c1ccnc(CC(=O)CC(C)C)n1.[C-]#[N+]c1ncc(CC(=O)CC(C)C)cn1.[C-]#[N+]c1nccc(CC(=O)CC(C)C)n1
• InChI: InChI=1S/C13H17NO3.4C11H13N3O.6C11H16N2O2.2C10H14N2O2.4C10H14N2O/c1-9(2)7-10(15)8-12-11(13(16)17-3)5-4-6-14-12;1-8(2)4-10(15)5-9-6-13-11(12-3)14-7-9;1-8(2)3-10(15)4-11-9(5-12)6-13-7-14-11;1-8(2)6-9(15)7-11-13-5-4-10(12-3)14-11;1-8(2)6-10(15)7-9-4-5-13-11(12-3)14-9;1-8(2)4-10(14)5-9-6-13-11(15-3)7-12-9;1-8(2)4-10(14)5-9-6-12-7-11(13-9)15-3;1-8(2)4-10(14)5-9-6-11(15-3)13-7-12-9;1-8(2)4-9(14)5-10-11(15-3)6-12-7-13-10;1-8(2)6-10(14)7-9-4-5-12-11(13-9)15-3;1-8(2)6-10(14)7-9-4-5-11(15-3)13-12-9;1-7(2)3-9(13)4-8-5-11-6-12-10(8)14;1-7(2)3-9(13)4-8-5-11-10(14)12-6-8;1-8(2)3-10(13)4-9-5-11-7-12-6-9;1-8(2)5-10(13)6-9-3-4-11-7-12-9;1-8(2)5-10(13)6-9-3-4-11-12-7-9;1-8(2)6-10(13)7-9-4-3-5-11-12-9/h4-6,9H,7-8H2,1-3H3;6-8H,4-5H2,1-2H3;6-8H,3-4H2,1-2H3;2*4-5,8H,6-7H2,1-2H3;4*6-8H,4-5H2,1-3H3;2*4-5,8H,6-7H2,1-3H3;2*5-7H,3-4H2,1-2H3,(H,11,12,14);5-8H,3-4H2,1-2H3;2*3-4,7-8H,5-6H2,1-2H3;3-5,8H,6-7H2,1-2H3
• InChIKey: HVUZRRQWBGFIFC-UHFFFAOYSA-N
• XLogP: 28.34
• TPSA: 874.05 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 59
• Rotatable Bonds: 75
• Heavy Atoms: 247
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3399.24
LogP ≤ 5	28.34
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	59

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one?

The IUPAC name of 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one (CID 158602561) is 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one.

What is the SMILES notation for 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one?

The canonical SMILES for 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one is CC(C)CC(=O)Cc1cccnn1.CC(C)CC(=O)Cc1ccncn1.CC(C)CC(=O)Cc1ccnnc1.CC(C)CC(=O)Cc1cnc(=O)[nH]c1.CC(C)CC(=O)Cc1cnc[nH]c1=O.CC(C)CC(=O)Cc1cncnc1.CC(C)CC(=O)Cc1ncncc1C#N.COC(=O)c1cccnc1CC(=O)CC(C)C.COc1cc(CC(=O)CC(C)C)ncn1.COc1ccc(CC(=O)CC(C)C)nn1.COc1cnc(CC(=O)CC(C)C)cn1.COc1cncc(CC(=O)CC(C)C)n1.COc1cncnc1CC(=O)CC(C)C.COc1nccc(CC(=O)CC(C)C)n1.[C-]#[N+]c1ccnc(CC(=O)CC(C)C)n1.[C-]#[N+]c1ncc(CC(=O)CC(C)C)cn1.[C-]#[N+]c1nccc(CC(=O)CC(C)C)n1.

What is the InChIKey of 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one?

The InChIKey is HVUZRRQWBGFIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3.4C11H13N3O.6C11H16N2O2.2C10H14N2O2.4C10H14N2O/c1-9(2)7-10(15)8-12-11(13(16)17-3)5-4-6-14-12;1-8(2)4-10(15)5-9-6-13-11(12-3)14-7-9;1-8(2)3-10(15)4-11-9(5-12)6-13-7-14-11;1-8(2)6-9(15)7-11-13-5-4-10(12-3)14-11;1-8(2)6-10(15)7-9-4-5-13-11(12-3)14-9;1-8(2)4-10(14)5-9-6-13-11(15-3)7-12-9;1-8(2)4-10(14)5-9-6-12-7-11(13-9)15-3;1-8(2)4-10(14)5-9-6-11(15-3)13-7-12-9;1-8(2)4-9(14)5-10-11(15-3)6-12-7-13-10;1-8(2)6-10(14)7-9-4-5-12-11(13-9)15-3;1-8(2)6-10(14)7-9-4-5-11(15-3)13-12-9;1-7(2)3-9(13)4-8-5-11-6-12-10(8)14;1-7(2)3-9(13)4-8-5-11-10(14)12-6-8;1-8(2)3-10(13)4-9-5-11-7-12-6-9;1-8(2)5-10(13)6-9-3-4-11-7-12-9;1-8(2)5-10(13)6-9-3-4-11-12-7-9;1-8(2)6-10(13)7-9-4-3-5-11-12-9/h4-6,9H,7-8H2,1-3H3;6-8H,4-5H2,1-2H3;6-8H,3-4H2,1-2H3;2*4-5,8H,6-7H2,1-2H3;4*6-8H,4-5H2,1-3H3;2*4-5,8H,6-7H2,1-3H3;2*5-7H,3-4H2,1-2H3,(H,11,12,14);5-8H,3-4H2,1-2H3;2*3-4,7-8H,5-6H2,1-2H3;3-5,8H,6-7H2,1-2H3.

What are the key properties of 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one?

1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one has a molecular weight of 3399.24 g/mol, XLogP of 28.34, 75 rotatable bonds, 2 hydrogen bond donors, and 59 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2-isocyanopyrimidin-4-yl)-4-methylpentan-2-one;1-(2-isocyanopyrimidin-5-yl)-4-methylpentan-2-one;1-(4-isocyanopyrimidin-2-yl)-4-methylpentan-2-one;1-(5-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyrazin-2-yl)-4-methylpentan-2-one;1-(6-methoxypyridazin-3-yl)-4-methylpentan-2-one;1-(2-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(5-methoxypyrimidin-4-yl)-4-methylpentan-2-one;1-(6-methoxypyrimidin-4-yl)-4-methylpentan-2-one;methyl 2-(4-methyl-2-oxopentyl)pyridine-3-carboxylate;4-(4-methyl-2-oxopentyl)pyrimidine-5-carbonitrile;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-2-one;5-(4-methyl-2-oxopentyl)-1H-pyrimidin-6-one;4-methyl-1-pyridazin-3-ylpentan-2-one;4-methyl-1-pyridazin-4-ylpentan-2-one;4-methyl-1-pyrimidin-4-ylpentan-2-one;4-methyl-1-pyrimidin-5-ylpentan-2-one is sourced from PubChem (CID 158602561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).