N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide

C11H16N4O2 — CID 59825246

IUPACN,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
SMILESCN(C)C(=O)Cc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C11H16N4O2/c1-15(2)9(16)6-8-10-7(4-3-5-12-10)11(17)14-13-8/h12H,3-6H2,1-2H3,(H,14,17)
InChIKeyIFZVTNHVPMFTHC-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.24
Rot. Bonds2

About N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide

N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide (PubChem CID 59825246) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
PubChem CID59825246
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
SMILESCN(C)C(=O)Cc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C11H16N4O2/c1-15(2)9(16)6-8-10-7(4-3-5-12-10)11(17)14-13-8/h12H,3-6H2,1-2H3,(H,14,17)
InChIKeyIFZVTNHVPMFTHC-UHFFFAOYSA-N
XLogP-0.24
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide (CID 59825246) is N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide is CN(C)C(=O)Cc1n[nH]c(=O)c2c1NCCC2.
What is the InChIKey of N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The InChIKey is IFZVTNHVPMFTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-15(2)9(16)6-8-10-7(4-3-5-12-10)11(17)14-13-8/h12H,3-6H2,1-2H3,(H,14,17).
What are the key properties of N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide has a molecular weight of 236.27 g/mol, XLogP of -0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide is sourced from PubChem (CID 59825246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).