N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide

C10H12N4O2 — CID 62850852

IUPACN-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide
SMILESCN(CCC#N)C(=O)Cn1ncccc1=O
InChIInChI=1S/C10H12N4O2/c1-13(7-3-5-11)10(16)8-14-9(15)4-2-6-12-14/h2,4,6H,3,7-8H2,1H3
InChIKeyHGMGTZDLWUQEKI-UHFFFAOYSA-N
MW220.23 g/mol
LogP-0.38
Rot. Bonds4

About N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide

N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide (PubChem CID 62850852) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide
PubChem CID62850852
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC NameN-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide
SMILESCN(CCC#N)C(=O)Cn1ncccc1=O
InChIInChI=1S/C10H12N4O2/c1-13(7-3-5-11)10(16)8-14-9(15)4-2-6-12-14/h2,4,6H,3,7-8H2,1H3
InChIKeyHGMGTZDLWUQEKI-UHFFFAOYSA-N
XLogP-0.38
TPSA78.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-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-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide?
The IUPAC name of N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide (CID 62850852) is N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide is CN(CCC#N)C(=O)Cn1ncccc1=O.
What is the InChIKey of N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide?
The InChIKey is HGMGTZDLWUQEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-13(7-3-5-11)10(16)8-14-9(15)4-2-6-12-14/h2,4,6H,3,7-8H2,1H3.
What are the key properties of N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide?
N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide has a molecular weight of 220.23 g/mol, XLogP of -0.38, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanoethyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 62850852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).