N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

C10H15N3O3 — CID 122132565

IUPACN-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCCOCCNC(=O)Cn1cccnc1=O
InChIInChI=1S/C10H15N3O3/c1-2-16-7-5-11-9(14)8-13-6-3-4-12-10(13)15/h3-4,6H,2,5,7-8H2,1H3,(H,11,14)
InChIKeyOBCHWESQTYQNNA-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.60
Rot. Bonds6

About N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (PubChem CID 122132565) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
PubChem CID122132565
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESCCOCCNC(=O)Cn1cccnc1=O
InChIInChI=1S/C10H15N3O3/c1-2-16-7-5-11-9(14)8-13-6-3-4-12-10(13)15/h3-4,6H,2,5,7-8H2,1H3,(H,11,14)
InChIKeyOBCHWESQTYQNNA-UHFFFAOYSA-N
XLogP-0.60
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-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

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (CID 122132565) is N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is CCOCCNC(=O)Cn1cccnc1=O.
What is the InChIKey of N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The InChIKey is OBCHWESQTYQNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-2-16-7-5-11-9(14)8-13-6-3-4-12-10(13)15/h3-4,6H,2,5,7-8H2,1H3,(H,11,14).
What are the key properties of N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide has a molecular weight of 225.25 g/mol, XLogP of -0.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 122132565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).