2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide

C10H16N4O2 — CID 103218347

IUPAC2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide
SMILESCCC(C)NC(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C10H16N4O2/c1-3-7(2)13-9(15)6-14-10(16)4-8(11)5-12-14/h4-5,7H,3,6,11H2,1-2H3,(H,13,15)
InChIKeyRWUVJQNOOASRKH-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.26
Rot. Bonds4

About 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide

2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide (PubChem CID 103218347) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide
PubChem CID103218347
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide
SMILESCCC(C)NC(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C10H16N4O2/c1-3-7(2)13-9(15)6-14-10(16)4-8(11)5-12-14/h4-5,7H,3,6,11H2,1-2H3,(H,13,15)
InChIKeyRWUVJQNOOASRKH-UHFFFAOYSA-N
XLogP-0.26
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide?
The IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide (CID 103218347) is 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide.
What is the SMILES notation for 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide?
The canonical SMILES for 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide is CCC(C)NC(=O)Cn1ncc(N)cc1=O.
What is the InChIKey of 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide?
The InChIKey is RWUVJQNOOASRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-3-7(2)13-9(15)6-14-10(16)4-8(11)5-12-14/h4-5,7H,3,6,11H2,1-2H3,(H,13,15).
What are the key properties of 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide?
2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide has a molecular weight of 224.26 g/mol, XLogP of -0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-oxopyridazin-1-yl)-N-butan-2-ylacetamide is sourced from PubChem (CID 103218347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).