2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one

C16H17N3O3 — CID 5053337

IUPAC2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCOCC1
InChIInChI=1S/C16H17N3O3/c20-15-7-6-14(13-4-2-1-3-5-13)17-19(15)12-16(21)18-8-10-22-11-9-18/h1-7H,8-12H2
InChIKeyNEYAPHQIZKIABM-UHFFFAOYSA-N
MW299.33 g/mol
LogP0.77
Rot. Bonds3

About 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one

2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one (PubChem CID 5053337) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one.

Molecular Properties

Compound Name2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one
PubChem CID5053337
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCOCC1
InChIInChI=1S/C16H17N3O3/c20-15-7-6-14(13-4-2-1-3-5-13)17-19(15)12-16(21)18-8-10-22-11-9-18/h1-7H,8-12H2
InChIKeyNEYAPHQIZKIABM-UHFFFAOYSA-N
XLogP0.77
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one?
The IUPAC name of 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one (CID 5053337) is 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one.
What is the SMILES notation for 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one?
The canonical SMILES for 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one is O=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCOCC1.
What is the InChIKey of 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one?
The InChIKey is NEYAPHQIZKIABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c20-15-7-6-14(13-4-2-1-3-5-13)17-19(15)12-16(21)18-8-10-22-11-9-18/h1-7H,8-12H2.
What are the key properties of 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one?
2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one has a molecular weight of 299.33 g/mol, XLogP of 0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-yl-2-oxoethyl)-6-phenylpyridazin-3-one is sourced from PubChem (CID 5053337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).