2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine

C15H23FN2O — CID 62121310

IUPAC2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine
SMILESCc1cc(C(CN)N2CCOC(C)(C)C2)ccc1F
InChIInChI=1S/C15H23FN2O/c1-11-8-12(4-5-13(11)16)14(9-17)18-6-7-19-15(2,3)10-18/h4-5,8,14H,6-7,9-10,17H2,1-3H3
InChIKeyQPSYOANJZSDIGH-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.24
Rot. Bonds3

About 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine

2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine (PubChem CID 62121310) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine
PubChem CID62121310
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine
SMILESCc1cc(C(CN)N2CCOC(C)(C)C2)ccc1F
InChIInChI=1S/C15H23FN2O/c1-11-8-12(4-5-13(11)16)14(9-17)18-6-7-19-15(2,3)10-18/h4-5,8,14H,6-7,9-10,17H2,1-3H3
InChIKeyQPSYOANJZSDIGH-UHFFFAOYSA-N
XLogP2.24
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine (CID 62121310) is 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine is Cc1cc(C(CN)N2CCOC(C)(C)C2)ccc1F.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine?
The InChIKey is QPSYOANJZSDIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-11-8-12(4-5-13(11)16)14(9-17)18-6-7-19-15(2,3)10-18/h4-5,8,14H,6-7,9-10,17H2,1-3H3.
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine?
2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine has a molecular weight of 266.36 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine is sourced from PubChem (CID 62121310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).