2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide

C20H18FN3O3 — CID 25885223

IUPAC2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-(2-fluorophenyl)acetamide
SMILESCCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)NC3=CC=CC=C3F
InChIInChI=1S/C20H18FN3O3/c1-2-27-15-9-7-14(8-10-15)18-11-20(26)24(13-22-18)12-19(25)23-17-6-4-3-5-16(17)21/h3-11,13H,2,12H2,1H3,(H,23,25)
InChIKeyMNLJYMBZWFPHOG-UHFFFAOYSA-N
MW367.40 g/mol
LogP2.40
Rot. Bonds6

About 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide

2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 25885223) has the molecular formula C20H18FN3O3 and a molecular weight of 367.40 g/mol. Its IUPAC name is 2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide
PubChem CID25885223
Molecular FormulaC20H18FN3O3
Molecular Weight367.40 g/mol
Exact Mass367.13
IUPAC Name2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-(2-fluorophenyl)acetamide
SMILESCCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)NC3=CC=CC=C3F
InChIInChI=1S/C20H18FN3O3/c1-2-27-15-9-7-14(8-10-15)18-11-20(26)24(13-22-18)12-19(25)23-17-6-4-3-5-16(17)21/h3-11,13H,2,12H2,1H3,(H,23,25)
InChIKeyMNLJYMBZWFPHOG-UHFFFAOYSA-N
XLogP2.40
TPSA71.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity599

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.40
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)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

2-cyclobutylsulfanyl-3-phenyl-6-[2-[5-[4-(trifluoromethyl)phenoxy]pentylamino]acetyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-one
CID 78322970
3-Anilino-5-(2,4-dimethylphenoxy)-1-methyl-pyrazin-2-one
CID 9966899
N-(4-fluorophenyl)-N'-[2-(4-methoxyphenyl)ethyl]ethanediamide
CID 2218015
N-[2-(4-methoxyphenyl)ethyl]-N'-phenyloxamide
CID 2218126
N'-(3-fluoro-4-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide
CID 7585167
N-[2-(4-methoxyphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 2096187
2-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-N-[(4-methoxyphenyl)methyl]acetamide
CID 2571798
2-(4-Ethoxy-phenylamino)-3-phenethyl-3,5-dihydro-imidazol-4-one
CID 6603168
2-(diethylamino)-5-(4-methoxybenzylidene)-3-phenyl-3,5-dihydro-4H-imidazol-4-one
CID 8185635
N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-4-phenylmethoxybenzamide
CID 9439606
(E)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-3-(4-phenylmethoxyphenyl)prop-2-enamide
CID 16229980
2-[methyl-[2-(4-methylphenoxy)acetyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 24982627

Frequently Asked Questions

What is the IUPAC name of 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide (CID 25885223) is 2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide is CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)NC3=CC=CC=C3F.
What is the InChIKey of 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is MNLJYMBZWFPHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-2-27-15-9-7-14(8-10-15)18-11-20(26)24(13-22-18)12-19(25)23-17-6-4-3-5-16(17)21/h3-11,13H,2,12H2,1H3,(H,23,25).
What are the key properties of 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide?
2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 367.40 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-(4-ethoxyphenyl)-6-oxopyrimidin-1(6H)-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 25885223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).