[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol

C11H15FN2O3 — CID 167838486

IUPAC[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol
SMILESCO[C@@H]1CN(c2ccncc2F)C[C@@H](CO)O1
InChIInChI=1S/C11H15FN2O3/c1-16-11-6-14(5-8(7-15)17-11)10-2-3-13-4-9(10)12/h2-4,8,11,15H,5-7H2,1H3/t8-,11-/m0/s1
InChIKeyVHQBCVIXOSBUSL-KWQFWETISA-N
MW242.25 g/mol
LogP0.39
Rot. Bonds3

About [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol

[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol (PubChem CID 167838486) has the molecular formula C11H15FN2O3 and a molecular weight of 242.25 g/mol. Its IUPAC name is [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol
PubChem CID167838486
Molecular FormulaC11H15FN2O3
Molecular Weight242.25 g/mol
Exact Mass242.11
IUPAC Name[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol
SMILESCO[C@@H]1CN(c2ccncc2F)C[C@@H](CO)O1
InChIInChI=1S/C11H15FN2O3/c1-16-11-6-14(5-8(7-15)17-11)10-2-3-13-4-9(10)12/h2-4,8,11,15H,5-7H2,1H3/t8-,11-/m0/s1
InChIKeyVHQBCVIXOSBUSL-KWQFWETISA-N
XLogP0.39
TPSA54.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol?
The IUPAC name of [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol (CID 167838486) is [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol?
The canonical SMILES for [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol is CO[C@@H]1CN(c2ccncc2F)C[C@@H](CO)O1.
What is the InChIKey of [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol?
The InChIKey is VHQBCVIXOSBUSL-KWQFWETISA-N. The full InChI is InChI=1S/C11H15FN2O3/c1-16-11-6-14(5-8(7-15)17-11)10-2-3-13-4-9(10)12/h2-4,8,11,15H,5-7H2,1H3/t8-,11-/m0/s1.
What are the key properties of [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol?
[(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol has a molecular weight of 242.25 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6S)-4-(3-fluoro-4-pyridinyl)-6-methoxymorpholin-2-yl]methanol is sourced from PubChem (CID 167838486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).