2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide

C13H20N4O4 — CID 71941541

IUPAC2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)NC(=O)Cn1[nH]c(=O)ccc1=O
InChIInChI=1S/C13H20N4O4/c1-10(8-16-4-6-21-7-5-16)14-12(19)9-17-13(20)3-2-11(18)15-17/h2-3,10H,4-9H2,1H3,(H,14,19)(H,15,18)
InChIKeyXZLZSQMMUQXEQM-UHFFFAOYSA-N
MW296.33 g/mol
LogP-1.63
Rot. Bonds5

About 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide

2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide (PubChem CID 71941541) has the molecular formula C13H20N4O4 and a molecular weight of 296.33 g/mol. Its IUPAC name is 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
PubChem CID71941541
Molecular FormulaC13H20N4O4
Molecular Weight296.33 g/mol
Exact Mass296.15
IUPAC Name2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)NC(=O)Cn1[nH]c(=O)ccc1=O
InChIInChI=1S/C13H20N4O4/c1-10(8-16-4-6-21-7-5-16)14-12(19)9-17-13(20)3-2-11(18)15-17/h2-3,10H,4-9H2,1H3,(H,14,19)(H,15,18)
InChIKeyXZLZSQMMUQXEQM-UHFFFAOYSA-N
XLogP-1.63
TPSA96.43 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 5-1.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2S)-1-[2-(2-amino-2-oxoethyl)-2-[(E)-4-(cyclopropylamino)-4-oxobut-2-enoyl]hydrazinyl]-1-oxopropan-2-yl]morpholine-4-carboxamide
CID 44549911
1-{2-[(2-Methoxy-1-methylethyl)amino]ethyl}-1,2-dihydropyridazine-3,6-dione
CID 50961301
2-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]-N-[2-(3,6-dioxo-3,6-dihydropyridazin-1(2H)-yl)ethyl]propanamide
CID 56876224
N-butan-2-yl-3-[2-(2-morpholin-4-yl-2-oxoacetyl)hydrazinyl]but-2-enamide
CID 4565778
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(2-methyl-2-morpholin-4-ylbutyl)acetamide
CID 45819350
N-[2-(4-acetylpiperazin-1-yl)ethyl]-2-(3,6-dioxo-1H-pyridazin-2-yl)acetamide
CID 53517567
2-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-1H-pyridazine-3,6-dione
CID 53525995
2-[2-(1-morpholin-4-ylpropan-2-ylamino)ethyl]-1H-pyridazine-3,6-dione
CID 56721913
2-(2-morpholin-4-yl-2-oxoethyl)-1H-pyridazine-3,6-dione
CID 60635736
ethyl 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]-propylamino]acetate
CID 61013010
ethyl 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]-propan-2-ylamino]acetate
CID 61022062
ethyl 2-[[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]amino]propanoate
CID 61344775

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The IUPAC name of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide (CID 71941541) is 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide is CC(CN1CCOCC1)NC(=O)Cn1[nH]c(=O)ccc1=O.
What is the InChIKey of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The InChIKey is XZLZSQMMUQXEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O4/c1-10(8-16-4-6-21-7-5-16)14-12(19)9-17-13(20)3-2-11(18)15-17/h2-3,10H,4-9H2,1H3,(H,14,19)(H,15,18).
What are the key properties of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide has a molecular weight of 296.33 g/mol, XLogP of -1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide is sourced from PubChem (CID 71941541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).