2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide

C21H28N4O2 — CID 91913718

IUPAC2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)Cn1c(N2CCCCC2)nc(C)c(C)c1=O
InChIInChI=1S/C21H28N4O2/c1-4-17-10-6-7-11-18(17)23-19(26)14-25-20(27)15(2)16(3)22-21(25)24-12-8-5-9-13-24/h6-7,10-11H,4-5,8-9,12-14H2,1-3H3,(H,23,26)
InChIKeyAYUBWYYZTFXGNV-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.05
Rot. Bonds5

About 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide

2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide (PubChem CID 91913718) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide
PubChem CID91913718
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC Name2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)Cn1c(N2CCCCC2)nc(C)c(C)c1=O
InChIInChI=1S/C21H28N4O2/c1-4-17-10-6-7-11-18(17)23-19(26)14-25-20(27)15(2)16(3)22-21(25)24-12-8-5-9-13-24/h6-7,10-11H,4-5,8-9,12-14H2,1-3H3,(H,23,26)
InChIKeyAYUBWYYZTFXGNV-UHFFFAOYSA-N
XLogP3.05
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)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

N-(2-chlorophenyl)-2-(4-methyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)acetamide
CID 53201687
2-(2-amino-4-methyl-6-oxopyrimidin-1-yl)-N-(2-ethylphenyl)acetamide
CID 53201648
N-[2-(2-ethylanilino)-2-oxoethyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 9488209
N-[2-(azepan-1-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 38283424
2-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 9436502
N-(2-ethylphenyl)-6-piperidin-1-ylpyridine-2-carboxamide
CID 84573709
N-[[1-[2-(2-ethylanilino)-2-oxoethyl]benzimidazol-2-yl]methyl]cyclohexanecarboxamide
CID 17029165
6-(azepan-1-yl)-N-(2-ethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 112847686
N-(2-ethylphenyl)-2-(1-methyl-4-oxo-[1,2,4]triazolo[4,3-a]quinoxalin-5-yl)acetamide
CID 53061514
2-(2-cyclohexylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 17028725
1-(2-ethylphenyl)-3-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]urea
CID 122318115
2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide (CID 91913718) is 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)Cn1c(N2CCCCC2)nc(C)c(C)c1=O.
What is the InChIKey of 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide?
The InChIKey is AYUBWYYZTFXGNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-4-17-10-6-7-11-18(17)23-19(26)14-25-20(27)15(2)16(3)22-21(25)24-12-8-5-9-13-24/h6-7,10-11H,4-5,8-9,12-14H2,1-3H3,(H,23,26).
What are the key properties of 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide?
2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide has a molecular weight of 368.48 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethyl-6-oxo-2-piperidin-1-ylpyrimidin-1-yl)-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 91913718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).