2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione

C11H15N3O5 — CID 81208767

IUPAC2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione
SMILESO=C(Cn1[nH]c(=O)ccc1=O)N1CCOC(CO)C1
InChIInChI=1S/C11H15N3O5/c15-7-8-5-13(3-4-19-8)11(18)6-14-10(17)2-1-9(16)12-14/h1-2,8,15H,3-7H2,(H,12,16)
InChIKeyOYVDXCLZSGRQKR-UHFFFAOYSA-N
MW269.26 g/mol
LogP-2.24
Rot. Bonds3

About 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione

2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione (PubChem CID 81208767) has the molecular formula C11H15N3O5 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione.

Molecular Properties

Compound Name2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione
PubChem CID81208767
Molecular FormulaC11H15N3O5
Molecular Weight269.26 g/mol
Exact Mass269.10
IUPAC Name2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione
SMILESO=C(Cn1[nH]c(=O)ccc1=O)N1CCOC(CO)C1
InChIInChI=1S/C11H15N3O5/c15-7-8-5-13(3-4-19-8)11(18)6-14-10(17)2-1-9(16)12-14/h1-2,8,15H,3-7H2,(H,12,16)
InChIKeyOYVDXCLZSGRQKR-UHFFFAOYSA-N
XLogP-2.24
TPSA104.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 5-2.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione?
The IUPAC name of 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione (CID 81208767) is 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione.
What is the SMILES notation for 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione?
The canonical SMILES for 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione is O=C(Cn1[nH]c(=O)ccc1=O)N1CCOC(CO)C1.
What is the InChIKey of 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione?
The InChIKey is OYVDXCLZSGRQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O5/c15-7-8-5-13(3-4-19-8)11(18)6-14-10(17)2-1-9(16)12-14/h1-2,8,15H,3-7H2,(H,12,16).
What are the key properties of 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione?
2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione has a molecular weight of 269.26 g/mol, XLogP of -2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione is sourced from PubChem (CID 81208767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).