2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine

C10H12ClFN2O2 — CID 114469123

IUPAC2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine
SMILESFc1cc(Cl)cnc1OCC1CNCCO1
InChIInChI=1S/C10H12ClFN2O2/c11-7-3-9(12)10(14-4-7)16-6-8-5-13-1-2-15-8/h3-4,8,13H,1-2,5-6H2
InChIKeyXLWCYTQKAACJCV-UHFFFAOYSA-N
MW246.67 g/mol
LogP1.24
Rot. Bonds3

About 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine

2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine (PubChem CID 114469123) has the molecular formula C10H12ClFN2O2 and a molecular weight of 246.67 g/mol. Its IUPAC name is 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine.

Molecular Properties

Compound Name2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine
PubChem CID114469123
Molecular FormulaC10H12ClFN2O2
Molecular Weight246.67 g/mol
Exact Mass246.06
IUPAC Name2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine
SMILESFc1cc(Cl)cnc1OCC1CNCCO1
InChIInChI=1S/C10H12ClFN2O2/c11-7-3-9(12)10(14-4-7)16-6-8-5-13-1-2-15-8/h3-4,8,13H,1-2,5-6H2
InChIKeyXLWCYTQKAACJCV-UHFFFAOYSA-N
XLogP1.24
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.67
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine?
The IUPAC name of 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine (CID 114469123) is 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine.
What is the SMILES notation for 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine?
The canonical SMILES for 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine is Fc1cc(Cl)cnc1OCC1CNCCO1.
What is the InChIKey of 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine?
The InChIKey is XLWCYTQKAACJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClFN2O2/c11-7-3-9(12)10(14-4-7)16-6-8-5-13-1-2-15-8/h3-4,8,13H,1-2,5-6H2.
What are the key properties of 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine?
2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine has a molecular weight of 246.67 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-3-fluoro-2-pyridinyl)oxymethyl]morpholine is sourced from PubChem (CID 114469123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).