(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone

C19H20FNO2 — CID 110369460

IUPAC(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
SMILESCc1ccc(C2CN(C(=O)c3ccc(F)cc3)C(C)CO2)cc1
InChIInChI=1S/C19H20FNO2/c1-13-3-5-15(6-4-13)18-11-21(14(2)12-23-18)19(22)16-7-9-17(20)10-8-16/h3-10,14,18H,11-12H2,1-2H3
InChIKeyOZYYRNXQAACJGF-UHFFFAOYSA-N
MW313.37 g/mol
LogP3.74
Rot. Bonds2

About (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone

(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone (PubChem CID 110369460) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
PubChem CID110369460
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
SMILESCc1ccc(C2CN(C(=O)c3ccc(F)cc3)C(C)CO2)cc1
InChIInChI=1S/C19H20FNO2/c1-13-3-5-15(6-4-13)18-11-21(14(2)12-23-18)19(22)16-7-9-17(20)10-8-16/h3-10,14,18H,11-12H2,1-2H3
InChIKeyOZYYRNXQAACJGF-UHFFFAOYSA-N
XLogP3.74
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone (CID 110369460) is (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone is Cc1ccc(C2CN(C(=O)c3ccc(F)cc3)C(C)CO2)cc1.
What is the InChIKey of (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone?
The InChIKey is OZYYRNXQAACJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c1-13-3-5-15(6-4-13)18-11-21(14(2)12-23-18)19(22)16-7-9-17(20)10-8-16/h3-10,14,18H,11-12H2,1-2H3.
What are the key properties of (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone?
(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone has a molecular weight of 313.37 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone is sourced from PubChem (CID 110369460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).