N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

C11H16N4O4 — CID 110742789

IUPACN-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCN1CC(CCNC(=O)C2=NNC(=O)CC2)OC1=O
InChIInChI=1S/C11H16N4O4/c1-15-6-7(19-11(15)18)4-5-12-10(17)8-2-3-9(16)14-13-8/h7H,2-6H2,1H3,(H,12,17)(H,14,16)
InChIKeyINHZIURZOZYRKH-UHFFFAOYSA-N
MW268.27 g/mol
LogP-0.79
Rot. Bonds4

About N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 110742789) has the molecular formula C11H16N4O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID110742789
Molecular FormulaC11H16N4O4
Molecular Weight268.27 g/mol
Exact Mass268.12
IUPAC NameN-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCN1CC(CCNC(=O)C2=NNC(=O)CC2)OC1=O
InChIInChI=1S/C11H16N4O4/c1-15-6-7(19-11(15)18)4-5-12-10(17)8-2-3-9(16)14-13-8/h7H,2-6H2,1H3,(H,12,17)(H,14,16)
InChIKeyINHZIURZOZYRKH-UHFFFAOYSA-N
XLogP-0.79
TPSA100.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 110742789) is N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is CN1CC(CCNC(=O)C2=NNC(=O)CC2)OC1=O.
What is the InChIKey of N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is INHZIURZOZYRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4/c1-15-6-7(19-11(15)18)4-5-12-10(17)8-2-3-9(16)14-13-8/h7H,2-6H2,1H3,(H,12,17)(H,14,16).
What are the key properties of N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 268.27 g/mol, XLogP of -0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 110742789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).