N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide

C15H24N4O3 — CID 71705011

IUPACN-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCOCCNC(=O)Cn1nc(N2CCC(C)CC2)ccc1=O
InChIInChI=1S/C15H24N4O3/c1-12-5-8-18(9-6-12)13-3-4-15(21)19(17-13)11-14(20)16-7-10-22-2/h3-4,12H,5-11H2,1-2H3,(H,16,20)
InChIKeyBNPZTUHHCJUEKB-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.24
Rot. Bonds6

About N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide

N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide (PubChem CID 71705011) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
PubChem CID71705011
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC NameN-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCOCCNC(=O)Cn1nc(N2CCC(C)CC2)ccc1=O
InChIInChI=1S/C15H24N4O3/c1-12-5-8-18(9-6-12)13-3-4-15(21)19(17-13)11-14(20)16-7-10-22-2/h3-4,12H,5-11H2,1-2H3,(H,16,20)
InChIKeyBNPZTUHHCJUEKB-UHFFFAOYSA-N
XLogP0.24
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-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-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide (CID 71705011) is N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide is COCCNC(=O)Cn1nc(N2CCC(C)CC2)ccc1=O.
What is the InChIKey of N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
The InChIKey is BNPZTUHHCJUEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-12-5-8-18(9-6-12)13-3-4-15(21)19(17-13)11-14(20)16-7-10-22-2/h3-4,12H,5-11H2,1-2H3,(H,16,20).
What are the key properties of N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide?
N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide has a molecular weight of 308.38 g/mol, XLogP of 0.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[3-(4-methylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetamide is sourced from PubChem (CID 71705011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).