2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide

C15H24N4O4 — CID 94024578

IUPAC2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide
SMILESCC[C@@](C)(CNC(=O)Cn1[nH]c(=O)ccc1=O)N1CCOCC1
InChIInChI=1S/C15H24N4O4/c1-3-15(2,18-6-8-23-9-7-18)11-16-13(21)10-19-14(22)5-4-12(20)17-19/h4-5H,3,6-11H2,1-2H3,(H,16,21)(H,17,20)/t15-/m0/s1
InChIKeyDGHZTFKYTMQURZ-HNNXBMFYSA-N
MW324.38 g/mol
LogP-0.85
Rot. Bonds6

About 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide

2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide (PubChem CID 94024578) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide.

Molecular Properties

Compound Name2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide
PubChem CID94024578
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide
SMILESCC[C@@](C)(CNC(=O)Cn1[nH]c(=O)ccc1=O)N1CCOCC1
InChIInChI=1S/C15H24N4O4/c1-3-15(2,18-6-8-23-9-7-18)11-16-13(21)10-19-14(22)5-4-12(20)17-19/h4-5H,3,6-11H2,1-2H3,(H,16,21)(H,17,20)/t15-/m0/s1
InChIKeyDGHZTFKYTMQURZ-HNNXBMFYSA-N
XLogP-0.85
TPSA96.43 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide with MolForge

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Related Compounds

2-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]-N-[2-(3,6-dioxo-3,6-dihydropyridazin-1(2H)-yl)ethyl]propanamide
CID 56876224
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 17440649
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(2-methyl-2-morpholin-4-ylbutyl)acetamide
CID 45819350
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
2-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]-1H-pyridazine-3,6-dione
CID 63606034
2-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]-1H-pyridazine-3,6-dione
CID 71899325
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 71941541
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2R)-2-methyl-2-morpholin-4-ylbutyl]acetamide
CID 94024580
2-[2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione
CID 95286332
2-[2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione
CID 95286333

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide?
The IUPAC name of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide (CID 94024578) is 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide.
What is the SMILES notation for 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide?
The canonical SMILES for 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide is CC[C@@](C)(CNC(=O)Cn1[nH]c(=O)ccc1=O)N1CCOCC1.
What is the InChIKey of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide?
The InChIKey is DGHZTFKYTMQURZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H24N4O4/c1-3-15(2,18-6-8-23-9-7-18)11-16-13(21)10-19-14(22)5-4-12(20)17-19/h4-5H,3,6-11H2,1-2H3,(H,16,21)(H,17,20)/t15-/m0/s1.
What are the key properties of 2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide?
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide has a molecular weight of 324.38 g/mol, XLogP of -0.85, 6 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-[(2S)-2-methyl-2-morpholin-4-ylbutyl]acetamide is sourced from PubChem (CID 94024578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).