[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol

C18H20FNO2 — CID 69431465

IUPAC[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)[C@H]1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C18H20FNO2/c19-16-8-6-15(7-9-16)18(21)17-13-20(10-11-22-17)12-14-4-2-1-3-5-14/h1-9,17-18,21H,10-13H2/t17-,18?/m1/s1
InChIKeyCRXKLCNVSNSQGH-QNSVNVJESA-N
MW301.36 g/mol
LogP2.76
Rot. Bonds4

About [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol

[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol (PubChem CID 69431465) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol
PubChem CID69431465
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC Name[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)[C@H]1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C18H20FNO2/c19-16-8-6-15(7-9-16)18(21)17-13-20(10-11-22-17)12-14-4-2-1-3-5-14/h1-9,17-18,21H,10-13H2/t17-,18?/m1/s1
InChIKeyCRXKLCNVSNSQGH-QNSVNVJESA-N
XLogP2.76
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-[(2R)-4-benzylmorpholin-2-yl]-phenylmethanol
CID 58997974
(R)-[(2S)-4-benzylmorpholin-2-yl]-phenylmethanol
CID 58997973
[(2R)-4-benzylmorpholin-2-yl]-(2-fluorophenyl)methanol
CID 69432470
CID 89203711
CID 89203711
(S)-[(2S)-4-benzylmorpholin-2-yl]-cyclohexa-1,5-dien-1-ylmethanol
CID 143010852
1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491103
(2R)-4-benzyl-2-[bromo-(4-chlorophenyl)methyl]morpholine
CID 69434313
(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
(2R)-4-benzyl-2-[2-(5-fluoro-2-methoxyphenyl)-1-phenylethyl]morpholine
CID 70335932
N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide
CID 46522835
4-benzyl-2-(tetrazolidin-5-yl)morpholine
CID 138059153
(2R)-4-[(4-fluorophenyl)methyl]-2-(phenoxymethyl)morpholine
CID 92984963

Frequently Asked Questions

What is the IUPAC name of [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol?
The IUPAC name of [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol (CID 69431465) is [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol.
What is the SMILES notation for [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol?
The canonical SMILES for [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol is OC(c1ccc(F)cc1)[C@H]1CN(Cc2ccccc2)CCO1.
What is the InChIKey of [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol?
The InChIKey is CRXKLCNVSNSQGH-QNSVNVJESA-N. The full InChI is InChI=1S/C18H20FNO2/c19-16-8-6-15(7-9-16)18(21)17-13-20(10-11-22-17)12-14-4-2-1-3-5-14/h1-9,17-18,21H,10-13H2/t17-,18?/m1/s1.
What are the key properties of [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol?
[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol has a molecular weight of 301.36 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol is sourced from PubChem (CID 69431465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).