2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol

C12H16FNO2 — CID 129349429

IUPAC2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol
SMILESOCCN1CCOC[C@H]1c1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c13-11-3-1-10(2-4-11)12-9-16-8-6-14(12)5-7-15/h1-4,12,15H,5-9H2/t12-/m0/s1
InChIKeyTXHQLPLKWBKHOG-LBPRGKRZSA-N
MW225.26 g/mol
LogP1.19
Rot. Bonds3

About 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol

2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol (PubChem CID 129349429) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol.

Molecular Properties

Compound Name2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol
PubChem CID129349429
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol
SMILESOCCN1CCOC[C@H]1c1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c13-11-3-1-10(2-4-11)12-9-16-8-6-14(12)5-7-15/h1-4,12,15H,5-9H2/t12-/m0/s1
InChIKeyTXHQLPLKWBKHOG-LBPRGKRZSA-N
XLogP1.19
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol?
The IUPAC name of 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol (CID 129349429) is 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol.
What is the SMILES notation for 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol?
The canonical SMILES for 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol is OCCN1CCOC[C@H]1c1ccc(F)cc1.
What is the InChIKey of 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol?
The InChIKey is TXHQLPLKWBKHOG-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H16FNO2/c13-11-3-1-10(2-4-11)12-9-16-8-6-14(12)5-7-15/h1-4,12,15H,5-9H2/t12-/m0/s1.
What are the key properties of 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol?
2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol has a molecular weight of 225.26 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-(4-fluorophenyl)morpholin-4-yl]ethanol is sourced from PubChem (CID 129349429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).