1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine

C13H19FN2O — CID 81491103

IUPAC1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccc(F)cc2)CCO1
InChIInChI=1S/C13H19FN2O/c1-10(15)13-9-16(6-7-17-13)8-11-2-4-12(14)5-3-11/h2-5,10,13H,6-9,15H2,1H3
InChIKeyKWNMCLRXLACTMZ-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.37
Rot. Bonds3

About 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine

1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine (PubChem CID 81491103) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
PubChem CID81491103
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC Name1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccc(F)cc2)CCO1
InChIInChI=1S/C13H19FN2O/c1-10(15)13-9-16(6-7-17-13)8-11-2-4-12(14)5-3-11/h2-5,10,13H,6-9,15H2,1H3
InChIKeyKWNMCLRXLACTMZ-UHFFFAOYSA-N
XLogP1.37
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
1-[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490139
1-[4-[(3-fluoro-4-methylphenyl)methyl]morpholin-2-yl]ethanamine
CID 113284985
1-[4-[(4-bromo-3-chlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 114077089
1-[4-[(4-nitrophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491183
1-[4-[(4-pyrazol-1-ylphenyl)methyl]morpholin-2-yl]ethanamine
CID 81497211
N-[4-[[2-(1-aminoethyl)morpholin-4-yl]methyl]phenyl]acetamide
CID 115314944
1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine
CID 115314919
1-[4-[(5-methylthiophen-2-yl)methyl]morpholin-2-yl]ethanamine
CID 115315061
[(2R)-4-benzylmorpholin-2-yl]-(4-fluorophenyl)methanol
CID 69431465
1-[4-[(4-chloro-2-pyridinyl)methyl]morpholin-2-yl]ethanamine
CID 115315468
1-[1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]propan-2-amine
CID 83986159

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine (CID 81491103) is 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine is CC(N)C1CN(Cc2ccc(F)cc2)CCO1.
What is the InChIKey of 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine?
The InChIKey is KWNMCLRXLACTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-10(15)13-9-16(6-7-17-13)8-11-2-4-12(14)5-3-11/h2-5,10,13H,6-9,15H2,1H3.
What are the key properties of 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine?
1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine has a molecular weight of 238.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine is sourced from PubChem (CID 81491103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).