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

C11H16N4O2 — CID 63254073

IUPACN-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
SMILESCCNC(=O)Cn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H16N4O2/c1-2-13-10(16)7-15-11(17)5-8-6-12-4-3-9(8)14-15/h5,12H,2-4,6-7H2,1H3,(H,13,16)
InChIKeyIEIPYORUZDXAAV-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.97
Rot. Bonds3

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

N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide (PubChem CID 63254073) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
PubChem CID63254073
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide
SMILESCCNC(=O)Cn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H16N4O2/c1-2-13-10(16)7-15-11(17)5-8-6-12-4-3-9(8)14-15/h5,12H,2-4,6-7H2,1H3,(H,13,16)
InChIKeyIEIPYORUZDXAAV-UHFFFAOYSA-N
XLogP-0.97
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The IUPAC name of N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide (CID 63254073) is N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide.
What is the SMILES notation for N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The canonical SMILES for N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide is CCNC(=O)Cn1nc2c(cc1=O)CNCC2.
What is the InChIKey of N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
The InChIKey is IEIPYORUZDXAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-2-13-10(16)7-15-11(17)5-8-6-12-4-3-9(8)14-15/h5,12H,2-4,6-7H2,1H3,(H,13,16).
What are the key properties of N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide?
N-ethyl-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 -0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2-yl)acetamide is sourced from PubChem (CID 63254073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).