4-benzyl-3-(4-fluorophenyl)morpholin-2-ol

C17H18FNO2 — CID 123159573

IUPAC4-benzyl-3-(4-fluorophenyl)morpholin-2-ol
SMILESOC1OCCN(Cc2ccccc2)C1c1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c18-15-8-6-14(7-9-15)16-17(20)21-11-10-19(16)12-13-4-2-1-3-5-13/h1-9,16-17,20H,10-12H2
InChIKeyORIBCQLRNMKTAW-UHFFFAOYSA-N
MW287.33 g/mol
LogP2.72
Rot. Bonds3

About 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol

4-benzyl-3-(4-fluorophenyl)morpholin-2-ol (PubChem CID 123159573) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol.

Molecular Properties

Compound Name4-benzyl-3-(4-fluorophenyl)morpholin-2-ol
PubChem CID123159573
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name4-benzyl-3-(4-fluorophenyl)morpholin-2-ol
SMILESOC1OCCN(Cc2ccccc2)C1c1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c18-15-8-6-14(7-9-15)16-17(20)21-11-10-19(16)12-13-4-2-1-3-5-13/h1-9,16-17,20H,10-12H2
InChIKeyORIBCQLRNMKTAW-UHFFFAOYSA-N
XLogP2.72
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol?
The IUPAC name of 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol (CID 123159573) is 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol.
What is the SMILES notation for 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol?
The canonical SMILES for 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol is OC1OCCN(Cc2ccccc2)C1c1ccc(F)cc1.
What is the InChIKey of 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol?
The InChIKey is ORIBCQLRNMKTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c18-15-8-6-14(7-9-15)16-17(20)21-11-10-19(16)12-13-4-2-1-3-5-13/h1-9,16-17,20H,10-12H2.
What are the key properties of 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol?
4-benzyl-3-(4-fluorophenyl)morpholin-2-ol has a molecular weight of 287.33 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-3-(4-fluorophenyl)morpholin-2-ol is sourced from PubChem (CID 123159573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).