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

C10H14N4O2 — CID 59825263

IUPACN-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
SMILESCNC(=O)Cc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C10H14N4O2/c1-11-8(15)5-7-9-6(3-2-4-12-9)10(16)14-13-7/h12H,2-5H2,1H3,(H,11,15)(H,14,16)
InChIKeyQAIJRFZVWCGRCI-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.58
Rot. Bonds2

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

N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide (PubChem CID 59825263) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
PubChem CID59825263
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
SMILESCNC(=O)Cc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C10H14N4O2/c1-11-8(15)5-7-9-6(3-2-4-12-9)10(16)14-13-7/h12H,2-5H2,1H3,(H,11,15)(H,14,16)
InChIKeyQAIJRFZVWCGRCI-UHFFFAOYSA-N
XLogP-0.58
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The IUPAC name of N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide (CID 59825263) is N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide.
What is the SMILES notation for N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The canonical SMILES for N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide is CNC(=O)Cc1n[nH]c(=O)c2c1NCCC2.
What is the InChIKey of N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
The InChIKey is QAIJRFZVWCGRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-11-8(15)5-7-9-6(3-2-4-12-9)10(16)14-13-7/h12H,2-5H2,1H3,(H,11,15)(H,14,16).
What are the key properties of N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide?
N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide has a molecular weight of 222.25 g/mol, XLogP of -0.58, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide is sourced from PubChem (CID 59825263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).