1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine

C16H25FN2O — CID 115996756

IUPAC1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine
SMILESCNC(c1ccccc1F)C(C)CN1CCOCC1C
InChIInChI=1S/C16H25FN2O/c1-12(10-19-8-9-20-11-13(19)2)16(18-3)14-6-4-5-7-15(14)17/h4-7,12-13,16,18H,8-11H2,1-3H3
InChIKeyUGUSWVSZSMLMAH-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.44
Rot. Bonds5

About 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine

1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine (PubChem CID 115996756) has the molecular formula C16H25FN2O and a molecular weight of 280.39 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine
PubChem CID115996756
Molecular FormulaC16H25FN2O
Molecular Weight280.39 g/mol
Exact Mass280.20
IUPAC Name1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine
SMILESCNC(c1ccccc1F)C(C)CN1CCOCC1C
InChIInChI=1S/C16H25FN2O/c1-12(10-19-8-9-20-11-13(19)2)16(18-3)14-6-4-5-7-15(14)17/h4-7,12-13,16,18H,8-11H2,1-3H3
InChIKeyUGUSWVSZSMLMAH-UHFFFAOYSA-N
XLogP2.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine 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-(2-fluorophenyl)-N-methyl-3-(3-methylmorpholin-4-yl)propan-1-amine
CID 62644652
1-(2-fluorophenyl)-N,2-dimethyl-3-piperazin-1-ylpropan-1-amine
CID 116960892
2-methyl-3-(3-methylmorpholin-4-yl)-1-phenylpropan-1-amine
CID 62619774
1-(2-fluorophenyl)-N,2-dimethyl-3-(1-oxo-1,4-thiazinan-4-yl)propan-1-amine
CID 115996832
2-(3-methylmorpholin-4-yl)-1-(2-methylphenyl)ethanamine
CID 43542047
2-(2-fluorophenyl)-2-(3-methylmorpholin-4-yl)ethanamine
CID 43541859
1-(2-fluorophenyl)-3-(3-methoxypiperidin-1-yl)-N,2-dimethylpropan-1-amine
CID 102967344
1-(2-fluorophenyl)-N,2-dimethylbutane-1,4-diamine
CID 116949640
1-cyclopentyl-N-methyl-2-(3-methylmorpholin-4-yl)ethanamine
CID 104744784
1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one
CID 43796410
3-(2,4-dimethylpiperidin-1-yl)-1-(2-fluorophenyl)-2-methylpropan-1-ol
CID 115997143
1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-1-one
CID 62619030

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine?
The IUPAC name of 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine (CID 115996756) is 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine is CNC(c1ccccc1F)C(C)CN1CCOCC1C.
What is the InChIKey of 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine?
The InChIKey is UGUSWVSZSMLMAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2O/c1-12(10-19-8-9-20-11-13(19)2)16(18-3)14-6-4-5-7-15(14)17/h4-7,12-13,16,18H,8-11H2,1-3H3.
What are the key properties of 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine?
1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine has a molecular weight of 280.39 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N,2-dimethyl-3-(3-methylmorpholin-4-yl)propan-1-amine is sourced from PubChem (CID 115996756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).