2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide

C13H20N4O3 — CID 103219832

IUPAC2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1ncc(NC2CC2)cc1=O
InChIInChI=1S/C13H20N4O3/c1-9(8-20-2)15-12(18)7-17-13(19)5-11(6-14-17)16-10-3-4-10/h5-6,9-10,16H,3-4,7-8H2,1-2H3,(H,15,18)
InChIKeyJJUGZFLYQCVBJN-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.03
Rot. Bonds7

About 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide

2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 103219832) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
PubChem CID103219832
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1ncc(NC2CC2)cc1=O
InChIInChI=1S/C13H20N4O3/c1-9(8-20-2)15-12(18)7-17-13(19)5-11(6-14-17)16-10-3-4-10/h5-6,9-10,16H,3-4,7-8H2,1-2H3,(H,15,18)
InChIKeyJJUGZFLYQCVBJN-UHFFFAOYSA-N
XLogP-0.03
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-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 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide (CID 103219832) is 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide is COCC(C)NC(=O)Cn1ncc(NC2CC2)cc1=O.
What is the InChIKey of 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is JJUGZFLYQCVBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-9(8-20-2)15-12(18)7-17-13(19)5-11(6-14-17)16-10-3-4-10/h5-6,9-10,16H,3-4,7-8H2,1-2H3,(H,15,18).
What are the key properties of 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 280.33 g/mol, XLogP of -0.03, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 103219832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).