4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one

C10H11FN2O2 — CID 166768562

IUPAC4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one
SMILESCc1cc(F)nc(N2CCOCC2=O)c1
InChIInChI=1S/C10H11FN2O2/c1-7-4-8(11)12-9(5-7)13-2-3-15-6-10(13)14/h4-5H,2-3,6H2,1H3
InChIKeyMLVRINAKWYNNDM-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.89
Rot. Bonds1

About 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one

4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one (PubChem CID 166768562) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one.

Molecular Properties

Compound Name4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one
PubChem CID166768562
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one
SMILESCc1cc(F)nc(N2CCOCC2=O)c1
InChIInChI=1S/C10H11FN2O2/c1-7-4-8(11)12-9(5-7)13-2-3-15-6-10(13)14/h4-5H,2-3,6H2,1H3
InChIKeyMLVRINAKWYNNDM-UHFFFAOYSA-N
XLogP0.89
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one?
The IUPAC name of 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one (CID 166768562) is 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one.
What is the SMILES notation for 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one?
The canonical SMILES for 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one is Cc1cc(F)nc(N2CCOCC2=O)c1.
What is the InChIKey of 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one?
The InChIKey is MLVRINAKWYNNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c1-7-4-8(11)12-9(5-7)13-2-3-15-6-10(13)14/h4-5H,2-3,6H2,1H3.
What are the key properties of 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one?
4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one has a molecular weight of 210.21 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-fluoro-4-methyl-2-pyridinyl)morpholin-3-one is sourced from PubChem (CID 166768562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).