2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide

C13H20N4O3 — CID 56762141

IUPAC2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1nc(N2CCOCC2)ccc1=O
InChIInChI=1S/C13H20N4O3/c1-10(2)14-12(18)9-17-13(19)4-3-11(15-17)16-5-7-20-8-6-16/h3-4,10H,5-9H2,1-2H3,(H,14,18)
InChIKeyPDSVNEGHYXRLPJ-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.40
Rot. Bonds4

About 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide

2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide (PubChem CID 56762141) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
PubChem CID56762141
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1nc(N2CCOCC2)ccc1=O
InChIInChI=1S/C13H20N4O3/c1-10(2)14-12(18)9-17-13(19)4-3-11(15-17)16-5-7-20-8-6-16/h3-4,10H,5-9H2,1-2H3,(H,14,18)
InChIKeyPDSVNEGHYXRLPJ-UHFFFAOYSA-N
XLogP-0.40
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide (CID 56762141) is 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1nc(N2CCOCC2)ccc1=O.
What is the InChIKey of 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is PDSVNEGHYXRLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-10(2)14-12(18)9-17-13(19)4-3-11(15-17)16-5-7-20-8-6-16/h3-4,10H,5-9H2,1-2H3,(H,14,18).
What are the key properties of 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide?
2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 280.33 g/mol, XLogP of -0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 56762141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).