N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide

C18H17N3O3 — CID 121090622

IUPACN-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide
SMILESCCN(C(=O)Cn1cnc(-c2ccco2)cc1=O)c1ccccc1
InChIInChI=1S/C18H17N3O3/c1-2-21(14-7-4-3-5-8-14)18(23)12-20-13-19-15(11-17(20)22)16-9-6-10-24-16/h3-11,13H,2,12H2,1H3
InChIKeyUEBHUUGDFMNEMQ-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.56
Rot. Bonds5

About N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide

N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide (PubChem CID 121090622) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide
PubChem CID121090622
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide
SMILESCCN(C(=O)Cn1cnc(-c2ccco2)cc1=O)c1ccccc1
InChIInChI=1S/C18H17N3O3/c1-2-21(14-7-4-3-5-8-14)18(23)12-20-13-19-15(11-17(20)22)16-9-6-10-24-16/h3-11,13H,2,12H2,1H3
InChIKeyUEBHUUGDFMNEMQ-UHFFFAOYSA-N
XLogP2.56
TPSA68.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide?
The IUPAC name of N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide (CID 121090622) is N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide is CCN(C(=O)Cn1cnc(-c2ccco2)cc1=O)c1ccccc1.
What is the InChIKey of N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide?
The InChIKey is UEBHUUGDFMNEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-2-21(14-7-4-3-5-8-14)18(23)12-20-13-19-15(11-17(20)22)16-9-6-10-24-16/h3-11,13H,2,12H2,1H3.
What are the key properties of N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide?
N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide has a molecular weight of 323.35 g/mol, XLogP of 2.56, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 121090622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).