2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide

C15H24N4O4 — CID 91924087

IUPAC2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide
SMILESCOCCn1ncc(N2CCC(NC(=O)COC)CC2)cc1=O
InChIInChI=1S/C15H24N4O4/c1-22-8-7-19-15(21)9-13(10-16-19)18-5-3-12(4-6-18)17-14(20)11-23-2/h9-10,12H,3-8,11H2,1-2H3,(H,17,20)
InChIKeyBMBZZEDBLGZUQI-UHFFFAOYSA-N
MW324.38 g/mol
LogP-0.38
Rot. Bonds7

About 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide

2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide (PubChem CID 91924087) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide
PubChem CID91924087
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide
SMILESCOCCn1ncc(N2CCC(NC(=O)COC)CC2)cc1=O
InChIInChI=1S/C15H24N4O4/c1-22-8-7-19-15(21)9-13(10-16-19)18-5-3-12(4-6-18)17-14(20)11-23-2/h9-10,12H,3-8,11H2,1-2H3,(H,17,20)
InChIKeyBMBZZEDBLGZUQI-UHFFFAOYSA-N
XLogP-0.38
TPSA85.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide?
The IUPAC name of 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide (CID 91924087) is 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide is COCCn1ncc(N2CCC(NC(=O)COC)CC2)cc1=O.
What is the InChIKey of 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide?
The InChIKey is BMBZZEDBLGZUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O4/c1-22-8-7-19-15(21)9-13(10-16-19)18-5-3-12(4-6-18)17-14(20)11-23-2/h9-10,12H,3-8,11H2,1-2H3,(H,17,20).
What are the key properties of 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide?
2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide has a molecular weight of 324.38 g/mol, XLogP of -0.38, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]acetamide is sourced from PubChem (CID 91924087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).