1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine

C14H21FN2O — CID 43544700

IUPAC1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine
SMILESCC1CN(c2ccc(C(C)N)cc2F)C(C)CO1
InChIInChI=1S/C14H21FN2O/c1-9-8-18-10(2)7-17(9)14-5-4-12(11(3)16)6-13(14)15/h4-6,9-11H,7-8,16H2,1-3H3
InChIKeyPVTFGTXRDIRQEH-UHFFFAOYSA-N
MW252.33 g/mol
LogP2.46
Rot. Bonds2

About 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine

1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine (PubChem CID 43544700) has the molecular formula C14H21FN2O and a molecular weight of 252.33 g/mol. Its IUPAC name is 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine.

Molecular Properties

Compound Name1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine
PubChem CID43544700
Molecular FormulaC14H21FN2O
Molecular Weight252.33 g/mol
Exact Mass252.16
IUPAC Name1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine
SMILESCC1CN(c2ccc(C(C)N)cc2F)C(C)CO1
InChIInChI=1S/C14H21FN2O/c1-9-8-18-10(2)7-17(9)14-5-4-12(11(3)16)6-13(14)15/h4-6,9-11H,7-8,16H2,1-3H3
InChIKeyPVTFGTXRDIRQEH-UHFFFAOYSA-N
XLogP2.46
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanol
CID 43544807
[4-[4-(1-aminoethyl)-2-fluorophenyl]-5-methylmorpholin-2-yl]methanol
CID 81204825
(1S)-1-[3-fluoro-4-(2-methylmorpholin-4-yl)phenyl]ethanamine
CID 55191172
2-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine
CID 55236575
4-(2,5-dimethylmorpholin-4-yl)-3-fluorobenzaldehyde
CID 43544756
(1S)-1-[4-(2,3-dimethylpiperidin-1-yl)-3-fluorophenyl]ethanamine
CID 78935591
[2-(2,5-dimethylmorpholin-4-yl)-5-fluorophenyl]methanamine
CID 43544860
1-[4-chloro-2-(2,5-dimethylmorpholin-4-yl)phenyl]propan-2-amine
CID 114860620
(1R)-1-[2-(2,5-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
CID 55185193
5-chloro-2-(2,5-dimethylmorpholin-4-yl)-4-fluoroaniline
CID 66076821
1-[5-chloro-2-(2,5-dimethylmorpholin-4-yl)phenyl]butan-2-amine
CID 114860621
(1R)-1-[4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-fluorophenyl]ethanamine
CID 113335787

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine?
The IUPAC name of 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine (CID 43544700) is 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine.
What is the SMILES notation for 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine?
The canonical SMILES for 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine is CC1CN(c2ccc(C(C)N)cc2F)C(C)CO1.
What is the InChIKey of 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine?
The InChIKey is PVTFGTXRDIRQEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O/c1-9-8-18-10(2)7-17(9)14-5-4-12(11(3)16)6-13(14)15/h4-6,9-11H,7-8,16H2,1-3H3.
What are the key properties of 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine?
1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine has a molecular weight of 252.33 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,5-dimethylmorpholin-4-yl)-3-fluorophenyl]ethanamine is sourced from PubChem (CID 43544700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).