2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide

C15H20N4O3 — CID 46961638

IUPAC2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)C(C)n1nc(-c2ccc(C)o2)cc(N)c1=O
InChIInChI=1S/C15H20N4O3/c1-4-7-17-14(20)10(3)19-15(21)11(16)8-12(18-19)13-6-5-9(2)22-13/h5-6,8,10H,4,7,16H2,1-3H3,(H,17,20)
InChIKeyJBPPTKREOOGFSJ-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.48
Rot. Bonds5

About 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide

2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide (PubChem CID 46961638) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide.

Molecular Properties

Compound Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide
PubChem CID46961638
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)C(C)n1nc(-c2ccc(C)o2)cc(N)c1=O
InChIInChI=1S/C15H20N4O3/c1-4-7-17-14(20)10(3)19-15(21)11(16)8-12(18-19)13-6-5-9(2)22-13/h5-6,8,10H,4,7,16H2,1-3H3,(H,17,20)
InChIKeyJBPPTKREOOGFSJ-UHFFFAOYSA-N
XLogP1.48
TPSA103.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide?
The IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide (CID 46961638) is 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide.
What is the SMILES notation for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide?
The canonical SMILES for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide is CCCNC(=O)C(C)n1nc(-c2ccc(C)o2)cc(N)c1=O.
What is the InChIKey of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide?
The InChIKey is JBPPTKREOOGFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-4-7-17-14(20)10(3)19-15(21)11(16)8-12(18-19)13-6-5-9(2)22-13/h5-6,8,10H,4,7,16H2,1-3H3,(H,17,20).
What are the key properties of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide?
2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide has a molecular weight of 304.35 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide is sourced from PubChem (CID 46961638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).