methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate

C10H15N3O4 — CID 43409014

IUPACmethyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C10H15N3O4/c1-12(6-9(15)17-3)10(16)7-4-5-8(14)13(2)11-7/h4-6H2,1-3H3
InChIKeyGSHUKBVPHQBFFM-UHFFFAOYSA-N
MW241.25 g/mol
LogP-0.77
Rot. Bonds3

About methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate

methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate (PubChem CID 43409014) has the molecular formula C10H15N3O4 and a molecular weight of 241.25 g/mol. Its IUPAC name is methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate
PubChem CID43409014
Molecular FormulaC10H15N3O4
Molecular Weight241.25 g/mol
Exact Mass241.11
IUPAC Namemethyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C10H15N3O4/c1-12(6-9(15)17-3)10(16)7-4-5-8(14)13(2)11-7/h4-6H2,1-3H3
InChIKeyGSHUKBVPHQBFFM-UHFFFAOYSA-N
XLogP-0.77
TPSA79.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 5-0.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate (CID 43409014) is methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate is COC(=O)CN(C)C(=O)C1=NN(C)C(=O)CC1.
What is the InChIKey of methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate?
The InChIKey is GSHUKBVPHQBFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O4/c1-12(6-9(15)17-3)10(16)7-4-5-8(14)13(2)11-7/h4-6H2,1-3H3.
What are the key properties of methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate?
methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate has a molecular weight of 241.25 g/mol, XLogP of -0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl-(1-methyl-6-oxo-4,5-dihydropyridazine-3-carbonyl)amino]acetate is sourced from PubChem (CID 43409014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).