1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol

C20H24FNO3 — CID 110929071

IUPAC1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
SMILESOC(COCc1ccccc1)CN1CCOC(c2ccccc2F)C1
InChIInChI=1S/C20H24FNO3/c21-19-9-5-4-8-18(19)20-13-22(10-11-25-20)12-17(23)15-24-14-16-6-2-1-3-7-16/h1-9,17,20,23H,10-15H2
InChIKeyWYBSAEPJYOAJIU-UHFFFAOYSA-N
MW345.41 g/mol
LogP2.78
Rot. Bonds7

About 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol

1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol (PubChem CID 110929071) has the molecular formula C20H24FNO3 and a molecular weight of 345.41 g/mol. Its IUPAC name is 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol.

Molecular Properties

Compound Name1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
PubChem CID110929071
Molecular FormulaC20H24FNO3
Molecular Weight345.41 g/mol
Exact Mass345.17
IUPAC Name1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
SMILESOC(COCc1ccccc1)CN1CCOC(c2ccccc2F)C1
InChIInChI=1S/C20H24FNO3/c21-19-9-5-4-8-18(19)20-13-22(10-11-25-20)12-17(23)15-24-14-16-6-2-1-3-7-16/h1-9,17,20,23H,10-15H2
InChIKeyWYBSAEPJYOAJIU-UHFFFAOYSA-N
XLogP2.78
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
CID 114398972
1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol
CID 110928528
(2S)-1-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-3-phenylmethoxypropan-2-ol
CID 95330936
1-[3-(2-methoxyphenyl)pyrrolidin-1-yl]-3-phenylmethoxypropan-2-ol
CID 111437418
(2S)-1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol
CID 740501
2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
CID 82024344
1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol chloride
CID 53346846
1-phenylmethoxy-3-piperidin-1-ylpropan-2-ol
CID 2769742
1-[(2R)-2-hydroxy-3-phenylmethoxypropyl]piperidin-4-ol
CID 95232047
1-(2-hydroxy-3-phenylmethoxypropyl)piperidin-4-ol
CID 60632394
(2S)-1-[(2-fluorophenyl)methoxy]-3-[(3S)-3-phenylpyrrolidin-1-yl]propan-2-ol
CID 95336881
1-[2-(4-bromophenyl)morpholin-4-yl]-3-(2-fluorophenoxy)propan-2-ol
CID 138960645

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The IUPAC name of 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol (CID 110929071) is 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol.
What is the SMILES notation for 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The canonical SMILES for 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol is OC(COCc1ccccc1)CN1CCOC(c2ccccc2F)C1.
What is the InChIKey of 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The InChIKey is WYBSAEPJYOAJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO3/c21-19-9-5-4-8-18(19)20-13-22(10-11-25-20)12-17(23)15-24-14-16-6-2-1-3-7-16/h1-9,17,20,23H,10-15H2.
What are the key properties of 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol has a molecular weight of 345.41 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol is sourced from PubChem (CID 110929071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).