2-(4-fluoro-3,5-dimethylphenyl)morpholine

C12H16FNO — CID 84780671

IUPAC2-(4-fluoro-3,5-dimethylphenyl)morpholine
SMILESCc1cc(C2CNCCO2)cc(C)c1F
InChIInChI=1S/C12H16FNO/c1-8-5-10(6-9(2)12(8)13)11-7-14-3-4-15-11/h5-6,11,14H,3-4,7H2,1-2H3
InChIKeyVOSLPEHSYNHUNH-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.10
Rot. Bonds1

About 2-(4-fluoro-3,5-dimethylphenyl)morpholine

2-(4-fluoro-3,5-dimethylphenyl)morpholine (PubChem CID 84780671) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 2-(4-fluoro-3,5-dimethylphenyl)morpholine.

Molecular Properties

Compound Name2-(4-fluoro-3,5-dimethylphenyl)morpholine
PubChem CID84780671
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name2-(4-fluoro-3,5-dimethylphenyl)morpholine
SMILESCc1cc(C2CNCCO2)cc(C)c1F
InChIInChI=1S/C12H16FNO/c1-8-5-10(6-9(2)12(8)13)11-7-14-3-4-15-11/h5-6,11,14H,3-4,7H2,1-2H3
InChIKeyVOSLPEHSYNHUNH-UHFFFAOYSA-N
XLogP2.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(4-fluoro-3-methylphenyl)morpholine
CID 94254202
2-(3,4-dimethylphenyl)morpholine
CID 43169342
2-(3-fluoro-4-methylphenyl)morpholine
CID 65122034
2-chloro-6-methyl-4-morpholin-2-ylphenol
CID 84791758
2-(3-fluoro-5-methoxy-4-methylphenyl)morpholine
CID 117323473
2-(2-fluoro-5-methoxy-3-methylphenyl)morpholine
CID 84790102
2-(3-bromo-4-methylphenyl)morpholine
CID 83730909
2-(3-chloro-5-methylphenyl)morpholine
CID 83703313
2-(3,5-dimethoxyphenyl)morpholine
CID 53414236
2-(4-bromo-2,3,5,6-tetrafluorophenyl)morpholine
CID 115111889
methyl 2,3-dimethyl-5-morpholin-2-ylbenzoate
CID 117376101
(2R)-2-(3-methylphenyl)morpholine
CID 42182782

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-3,5-dimethylphenyl)morpholine?
The IUPAC name of 2-(4-fluoro-3,5-dimethylphenyl)morpholine (CID 84780671) is 2-(4-fluoro-3,5-dimethylphenyl)morpholine.
What is the SMILES notation for 2-(4-fluoro-3,5-dimethylphenyl)morpholine?
The canonical SMILES for 2-(4-fluoro-3,5-dimethylphenyl)morpholine is Cc1cc(C2CNCCO2)cc(C)c1F.
What is the InChIKey of 2-(4-fluoro-3,5-dimethylphenyl)morpholine?
The InChIKey is VOSLPEHSYNHUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-8-5-10(6-9(2)12(8)13)11-7-14-3-4-15-11/h5-6,11,14H,3-4,7H2,1-2H3.
What are the key properties of 2-(4-fluoro-3,5-dimethylphenyl)morpholine?
2-(4-fluoro-3,5-dimethylphenyl)morpholine has a molecular weight of 209.26 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-3,5-dimethylphenyl)morpholine is sourced from PubChem (CID 84780671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).