(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine

C18H17FN2O2S — CID 36873434

IUPAC(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine
SMILESFc1ccc([C@@H]2CN(Cc3cc(-c4cccs4)on3)CCO2)cc1
InChIInChI=1S/C18H17FN2O2S/c19-14-5-3-13(4-6-14)17-12-21(7-8-22-17)11-15-10-16(23-20-15)18-2-1-9-24-18/h1-6,9-10,17H,7-8,11-12H2/t17-/m0/s1
InChIKeyLVPXVEDFENXEOB-KRWDZBQOSA-N
MW344.41 g/mol
LogP4.12
Rot. Bonds4

About (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine

(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine (PubChem CID 36873434) has the molecular formula C18H17FN2O2S and a molecular weight of 344.41 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine
PubChem CID36873434
Molecular FormulaC18H17FN2O2S
Molecular Weight344.41 g/mol
Exact Mass344.10
IUPAC Name(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine
SMILESFc1ccc([C@@H]2CN(Cc3cc(-c4cccs4)on3)CCO2)cc1
InChIInChI=1S/C18H17FN2O2S/c19-14-5-3-13(4-6-14)17-12-21(7-8-22-17)11-15-10-16(23-20-15)18-2-1-9-24-18/h1-6,9-10,17H,7-8,11-12H2/t17-/m0/s1
InChIKeyLVPXVEDFENXEOB-KRWDZBQOSA-N
XLogP4.12
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine?
The IUPAC name of (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine (CID 36873434) is (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine.
What is the SMILES notation for (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine?
The canonical SMILES for (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine is Fc1ccc([C@@H]2CN(Cc3cc(-c4cccs4)on3)CCO2)cc1.
What is the InChIKey of (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine?
The InChIKey is LVPXVEDFENXEOB-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H17FN2O2S/c19-14-5-3-13(4-6-14)17-12-21(7-8-22-17)11-15-10-16(23-20-15)18-2-1-9-24-18/h1-6,9-10,17H,7-8,11-12H2/t17-/m0/s1.
What are the key properties of (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine?
(2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine has a molecular weight of 344.41 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenyl)-4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]morpholine is sourced from PubChem (CID 36873434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).