3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one

C15H14FN3O3 — CID 38372172

IUPAC3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one
SMILESO=C(c1ccc(=O)[nH]n1)N1CCO[C@H](c2ccc(F)cc2)C1
InChIInChI=1S/C15H14FN3O3/c16-11-3-1-10(2-4-11)13-9-19(7-8-22-13)15(21)12-5-6-14(20)18-17-12/h1-6,13H,7-9H2,(H,18,20)/t13-/m0/s1
InChIKeyLJWCJZWCNVOONV-ZDUSSCGKSA-N
MW303.29 g/mol
LogP1.12
Rot. Bonds2

About 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one

3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one (PubChem CID 38372172) has the molecular formula C15H14FN3O3 and a molecular weight of 303.29 g/mol. Its IUPAC name is 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one
PubChem CID38372172
Molecular FormulaC15H14FN3O3
Molecular Weight303.29 g/mol
Exact Mass303.10
IUPAC Name3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one
SMILESO=C(c1ccc(=O)[nH]n1)N1CCO[C@H](c2ccc(F)cc2)C1
InChIInChI=1S/C15H14FN3O3/c16-11-3-1-10(2-4-11)13-9-19(7-8-22-13)15(21)12-5-6-14(20)18-17-12/h1-6,13H,7-9H2,(H,18,20)/t13-/m0/s1
InChIKeyLJWCJZWCNVOONV-ZDUSSCGKSA-N
XLogP1.12
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.29
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one?
The IUPAC name of 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one (CID 38372172) is 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one.
What is the SMILES notation for 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one?
The canonical SMILES for 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one is O=C(c1ccc(=O)[nH]n1)N1CCO[C@H](c2ccc(F)cc2)C1.
What is the InChIKey of 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one?
The InChIKey is LJWCJZWCNVOONV-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H14FN3O3/c16-11-3-1-10(2-4-11)13-9-19(7-8-22-13)15(21)12-5-6-14(20)18-17-12/h1-6,13H,7-9H2,(H,18,20)/t13-/m0/s1.
What are the key properties of 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one?
3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one has a molecular weight of 303.29 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridazin-6-one is sourced from PubChem (CID 38372172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).