2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide

C14H14FN3O2 — CID 121064421

IUPAC2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
SMILESCCc1cc(=O)n(CC(=O)Nc2cccc(F)c2)cn1
InChIInChI=1S/C14H14FN3O2/c1-2-11-7-14(20)18(9-16-11)8-13(19)17-12-5-3-4-10(15)6-12/h3-7,9H,2,8H2,1H3,(H,17,19)
InChIKeyAANWXULHUDECDI-UHFFFAOYSA-N
MW275.28 g/mol
LogP1.58
Rot. Bonds4

About 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide

2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide (PubChem CID 121064421) has the molecular formula C14H14FN3O2 and a molecular weight of 275.28 g/mol. Its IUPAC name is 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
PubChem CID121064421
Molecular FormulaC14H14FN3O2
Molecular Weight275.28 g/mol
Exact Mass275.11
IUPAC Name2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
SMILESCCc1cc(=O)n(CC(=O)Nc2cccc(F)c2)cn1
InChIInChI=1S/C14H14FN3O2/c1-2-11-7-14(20)18(9-16-11)8-13(19)17-12-5-3-4-10(15)6-12/h3-7,9H,2,8H2,1H3,(H,17,19)
InChIKeyAANWXULHUDECDI-UHFFFAOYSA-N
XLogP1.58
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-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

N-(3-fluorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679426
2-(4,5-dimethylimidazol-1-yl)-N-(3-fluorophenyl)acetamide
CID 115616714
N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethyl-6-oxopyrimidin-1-yl)acetamide
CID 121064355
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(4-nitrophenyl)acetamide
CID 121064301
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(2-methoxyphenyl)acetamide
CID 121064425
2-(4-butyl-6-oxopyrimidin-1-yl)-N-(3,4-difluorophenyl)acetamide
CID 121063521
2-(4-chloro-5-iodo-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
CID 114584066
N-(2-cyanophenyl)-2-(4-ethyl-6-oxopyrimidin-1-yl)acetamide
CID 121064373
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 121064314
N-[4-(2-acetamidoethoxy)phenyl]-2-(4-ethyl-6-oxopyrimidin-1-yl)acetamide
CID 121064479
N-(3-ethylphenyl)-2-(6-fluoro-4-oxoquinazolin-3-yl)acetamide
CID 46583999
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 121064311

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide (CID 121064421) is 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide is CCc1cc(=O)n(CC(=O)Nc2cccc(F)c2)cn1.
What is the InChIKey of 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide?
The InChIKey is AANWXULHUDECDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O2/c1-2-11-7-14(20)18(9-16-11)8-13(19)17-12-5-3-4-10(15)6-12/h3-7,9H,2,8H2,1H3,(H,17,19).
What are the key properties of 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide?
2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide has a molecular weight of 275.28 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 121064421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).