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

C18H20FNO3 — CID 124614792

IUPAC4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol
SMILESCOc1cc(CN2CCO[C@H](c3cccc(F)c3)C2)ccc1O
InChIInChI=1S/C18H20FNO3/c1-22-17-9-13(5-6-16(17)21)11-20-7-8-23-18(12-20)14-3-2-4-15(19)10-14/h2-6,9-10,18,21H,7-8,11-12H2,1H3/t18-/m0/s1
InChIKeyZHTSURKPPVEPAU-SFHVURJKSA-N
MW317.36 g/mol
LogP3.11
Rot. Bonds4

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

4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol (PubChem CID 124614792) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol
PubChem CID124614792
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol
SMILESCOc1cc(CN2CCO[C@H](c3cccc(F)c3)C2)ccc1O
InChIInChI=1S/C18H20FNO3/c1-22-17-9-13(5-6-16(17)21)11-20-7-8-23-18(12-20)14-3-2-4-15(19)10-14/h2-6,9-10,18,21H,7-8,11-12H2,1H3/t18-/m0/s1
InChIKeyZHTSURKPPVEPAU-SFHVURJKSA-N
XLogP3.11
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2R)-2-(4-fluorophenyl)morpholin-4-yl]methyl]-4,5-dimethoxyphenol
CID 97063266
2-(3-fluorophenyl)-4-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]morpholine
CID 126792008
[2-(3-fluorophenyl)morpholin-4-yl]methyl-trimethylsilane
CID 86902020
4-[[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]methyl]-2,6-dimethoxyphenol
CID 95553357
2-methoxy-4-[(2-methyl-1,4-oxazepan-4-yl)methyl]phenol
CID 82980162
4-[2-(1,3-dioxolan-2-yl)ethyl]-2-(3-fluorophenyl)morpholine
CID 86795528
4-[(2-fluoro-4,5-dimethoxyphenyl)methyl]-2-phenylmorpholine
CID 74237175
5-[[2-(3-fluorophenyl)morpholin-4-yl]methyl]thiophene-2-carboxylic acid
CID 138003841
4-[[1-(3-fluorophenyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepin-2-yl]methyl]-2-methoxyphenol
CID 42845585
2-(3-fluorophenyl)-4-methylmorpholine
CID 77271439
4-(4-benzylmorpholin-2-yl)-2-chlorophenol
CID 66654072
4-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-2-methoxyphenol
CID 104961912

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol?
The IUPAC name of 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol (CID 124614792) is 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol.
What is the SMILES notation for 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol?
The canonical SMILES for 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol is COc1cc(CN2CCO[C@H](c3cccc(F)c3)C2)ccc1O.
What is the InChIKey of 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol?
The InChIKey is ZHTSURKPPVEPAU-SFHVURJKSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-22-17-9-13(5-6-16(17)21)11-20-7-8-23-18(12-20)14-3-2-4-15(19)10-14/h2-6,9-10,18,21H,7-8,11-12H2,1H3/t18-/m0/s1.
What are the key properties of 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol?
4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol has a molecular weight of 317.36 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-2-(3-fluorophenyl)morpholin-4-yl]methyl]-2-methoxyphenol is sourced from PubChem (CID 124614792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).