2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide

C18H18N4O4 — CID 175268963

IUPAC2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide
SMILESCOc1cccc(-c2cc(NC(=O)CC3CC(=O)NC(=O)C3)ncn2)c1
InChIInChI=1S/C18H18N4O4/c1-26-13-4-2-3-12(8-13)14-9-15(20-10-19-14)21-16(23)5-11-6-17(24)22-18(25)7-11/h2-4,8-11H,5-7H2,1H3,(H,22,24,25)(H,19,20,21,23)
InChIKeyOBOHMDYPUMIYHH-UHFFFAOYSA-N
MW354.37 g/mol
LogP1.53
Rot. Bonds5

About 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide

2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide (PubChem CID 175268963) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide
PubChem CID175268963
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC Name2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide
SMILESCOc1cccc(-c2cc(NC(=O)CC3CC(=O)NC(=O)C3)ncn2)c1
InChIInChI=1S/C18H18N4O4/c1-26-13-4-2-3-12(8-13)14-9-15(20-10-19-14)21-16(23)5-11-6-17(24)22-18(25)7-11/h2-4,8-11H,5-7H2,1H3,(H,22,24,25)(H,19,20,21,23)
InChIKeyOBOHMDYPUMIYHH-UHFFFAOYSA-N
XLogP1.53
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]-2-phenylpropanamide
CID 174623305
2-(4-methoxyphenoxy)-N-[6-(4-methoxyphenyl)pyrimidin-4-yl]acetamide
CID 166327221
2-cyclohexyl-N-[6-(3-methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetamide
CID 143879129
4-(3-methoxyphenyl)-6-methylpyrimidine
CID 58973518
3-(3-methoxyphenyl)-N-(6-piperidin-1-ylpyrimidin-4-yl)-1H-pyrazole-5-carboxamide
CID 90544593
[6-(3-methoxyphenyl)pyrimidin-4-yl]methanamine
CID 28904662
[5-[[6-(3-methoxyphenyl)pyrimidin-4-yl]carbamoyl]-N,2-dimethylanilino] hydrogen sulfite
CID 174608658
[5-[[6-(3-methoxyphenyl)pyrimidin-4-yl]carbamoyl]-N,2-dimethylanilino] sulfite
CID 174608657
3-N-[6-(4-methoxyphenyl)pyrimidin-4-yl]-1-N-phenylbenzene-1,3-dicarboxamide
CID 166327273
N-cyclohexyl-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19509722
N-(2-methoxyphenyl)-3-[[6-(3-methoxyphenyl)pyrimidin-4-yl]amino]benzenesulfonamide
CID 25017279
3-(3-methoxyphenyl)-1-methyl-N-(6-piperidin-1-ylpyrimidin-4-yl)pyrazole-5-carboxamide
CID 90544707

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide?
The IUPAC name of 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide (CID 175268963) is 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide.
What is the SMILES notation for 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide?
The canonical SMILES for 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide is COc1cccc(-c2cc(NC(=O)CC3CC(=O)NC(=O)C3)ncn2)c1.
What is the InChIKey of 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide?
The InChIKey is OBOHMDYPUMIYHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-26-13-4-2-3-12(8-13)14-9-15(20-10-19-14)21-16(23)5-11-6-17(24)22-18(25)7-11/h2-4,8-11H,5-7H2,1H3,(H,22,24,25)(H,19,20,21,23).
What are the key properties of 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide?
2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide has a molecular weight of 354.37 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dioxopiperidin-4-yl)-N-[6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide is sourced from PubChem (CID 175268963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).