1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine

C14H21FN2O — CID 116911058

IUPAC1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine
SMILESCN(C)C(CC1COCCN1)c1ccccc1F
InChIInChI=1S/C14H21FN2O/c1-17(2)14(9-11-10-18-8-7-16-11)12-5-3-4-6-13(12)15/h3-6,11,14,16H,7-10H2,1-2H3
InChIKeySBSSGLBJECRQDP-UHFFFAOYSA-N
MW252.33 g/mol
LogP1.81
Rot. Bonds4

About 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine

1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine (PubChem CID 116911058) has the molecular formula C14H21FN2O and a molecular weight of 252.33 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine
PubChem CID116911058
Molecular FormulaC14H21FN2O
Molecular Weight252.33 g/mol
Exact Mass252.16
IUPAC Name1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine
SMILESCN(C)C(CC1COCCN1)c1ccccc1F
InChIInChI=1S/C14H21FN2O/c1-17(2)14(9-11-10-18-8-7-16-11)12-5-3-4-6-13(12)15/h3-6,11,14,16H,7-10H2,1-2H3
InChIKeySBSSGLBJECRQDP-UHFFFAOYSA-N
XLogP1.81
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.33
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluorophenyl)-N,N-dimethyl-2-piperidin-2-ylethanamine
CID 116906803
1-(2-methoxyphenyl)-2-morpholin-3-ylethanol
CID 81466986
N-[2-(2-fluorophenyl)ethyl]-N-methyl-2-morpholin-3-ylethanamine
CID 115239045
(3R)-N-[(2R)-2-(2-fluorophenyl)-2-hydroxyethyl]morpholine-3-carboxamide
CID 124588211
3-[2-(2,6-difluorophenyl)ethyl]morpholine
CID 104704070
1-(2,4-difluorophenyl)-2-morpholin-3-ylethanol
CID 81467090
1-(2-fluorophenyl)-N-methyl-N-(oxolan-3-yl)ethane-1,2-diamine
CID 82733450
3-(2-methylpropyl)morpholine
CID 20811826
2-(2,6-difluorophenyl)-1-morpholin-3-ylpropan-2-ol
CID 113462063
N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine
CID 116911069
3-[(2-chloro-6-fluorophenyl)methyl]morpholine
CID 82288651
3-[3-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-methylpropyl]morpholine
CID 112745796

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine?
The IUPAC name of 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine (CID 116911058) is 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine is CN(C)C(CC1COCCN1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine?
The InChIKey is SBSSGLBJECRQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O/c1-17(2)14(9-11-10-18-8-7-16-11)12-5-3-4-6-13(12)15/h3-6,11,14,16H,7-10H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine?
1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine has a molecular weight of 252.33 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N,N-dimethyl-2-morpholin-3-ylethanamine is sourced from PubChem (CID 116911058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).