2-benzyl-4-[(2-fluorophenyl)methyl]morpholine

C18H20FNO — CID 45194877

IUPAC2-benzyl-4-[(2-fluorophenyl)methyl]morpholine
SMILESFc1ccccc1CN1CCOC(Cc2ccccc2)C1
InChIInChI=1S/C18H20FNO/c19-18-9-5-4-8-16(18)13-20-10-11-21-17(14-20)12-15-6-2-1-3-7-15/h1-9,17H,10-14H2
InChIKeyWRYILGURXDGWDN-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.27
Rot. Bonds4

About 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine

2-benzyl-4-[(2-fluorophenyl)methyl]morpholine (PubChem CID 45194877) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine.

Molecular Properties

Compound Name2-benzyl-4-[(2-fluorophenyl)methyl]morpholine
PubChem CID45194877
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name2-benzyl-4-[(2-fluorophenyl)methyl]morpholine
SMILESFc1ccccc1CN1CCOC(Cc2ccccc2)C1
InChIInChI=1S/C18H20FNO/c19-18-9-5-4-8-16(18)13-20-10-11-21-17(14-20)12-15-6-2-1-3-7-15/h1-9,17H,10-14H2
InChIKeyWRYILGURXDGWDN-UHFFFAOYSA-N
XLogP3.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ML398
CID 72737723
4-Benzyl-2-(2-phenylethyl)morpholine
CID 20354789
(6-Benzhydryl-tetrahydro-pyran-3-yl)-(4-fluoro-benzyl)-amine
CID 44287455
Perastine
CID 411828
1-(4-Fluoro-benzyl)-4-[2-(1-phenyl-ethoxy)-ethyl]-piperidine
CID 9924118
1-(1-Benzylpiperidin-4-yl)-2-phenylethanol;hydrochloride
CID 10088107
1-Benzyl-4-(4-phenylbutoxymethyl)piperidine;hydrochloride
CID 45262131
1-Benzyl-4-(cyclohexyloxymethyl)piperidine;hydrochloride
CID 45262148
1-(1-Benzylpiperidin-4-yl)-2-(4-fluorophenyl)ethanol;hydrate;hydrochloride
CID 45262157
1-Benzyl-4-(5-phenylpentoxymethyl)piperidine;hydrochloride
CID 45262192
4-[(4-Fluorophenyl)methyl]-2-(2-phenylethyl)morpholine
CID 72737750
Morpholine, 4-[(4-chlorophenyl)methyl]-2-(2-phenylethyl)-, (2R)-
CID 72737767

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine?
The IUPAC name of 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine (CID 45194877) is 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine.
What is the SMILES notation for 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine?
The canonical SMILES for 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine is Fc1ccccc1CN1CCOC(Cc2ccccc2)C1.
What is the InChIKey of 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine?
The InChIKey is WRYILGURXDGWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c19-18-9-5-4-8-16(18)13-20-10-11-21-17(14-20)12-15-6-2-1-3-7-15/h1-9,17H,10-14H2.
What are the key properties of 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine?
2-benzyl-4-[(2-fluorophenyl)methyl]morpholine has a molecular weight of 285.36 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-[(2-fluorophenyl)methyl]morpholine is sourced from PubChem (CID 45194877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).