N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide

C11H16N4O2 — CID 63253323

IUPACN,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
SMILESCN(C)C(=O)Cn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H16N4O2/c1-14(2)11(17)7-15-10(16)5-8-6-12-4-3-9(8)13-15/h5,12H,3-4,6-7H2,1-2H3
InChIKeyFLKQJPMLJFMOAL-UHFFFAOYSA-N
MW236.27 g/mol
LogP-1.02
Rot. Bonds2

About N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide

N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide (PubChem CID 63253323) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
PubChem CID63253323
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
SMILESCN(C)C(=O)Cn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H16N4O2/c1-14(2)11(17)7-15-10(16)5-8-6-12-4-3-9(8)13-15/h5,12H,3-4,6-7H2,1-2H3
InChIKeyFLKQJPMLJFMOAL-UHFFFAOYSA-N
XLogP-1.02
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-1.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide (CID 63253323) is N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide is CN(C)C(=O)Cn1nc2c(cc1=O)CNCC2.
What is the InChIKey of N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The InChIKey is FLKQJPMLJFMOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-14(2)11(17)7-15-10(16)5-8-6-12-4-3-9(8)13-15/h5,12H,3-4,6-7H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide has a molecular weight of 236.27 g/mol, XLogP of -1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide is sourced from PubChem (CID 63253323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).