4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline

C13H19FN2O — CID 115239076

IUPAC4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline
SMILESCc1cc(NCCC2CNCCO2)ccc1F
InChIInChI=1S/C13H19FN2O/c1-10-8-11(2-3-13(10)14)16-5-4-12-9-15-6-7-17-12/h2-3,8,12,15-16H,4-7,9H2,1H3
InChIKeyHLUYPJAJUAAGJC-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.92
Rot. Bonds4

About 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline

4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline (PubChem CID 115239076) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline.

Molecular Properties

Compound Name4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline
PubChem CID115239076
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC Name4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline
SMILESCc1cc(NCCC2CNCCO2)ccc1F
InChIInChI=1S/C13H19FN2O/c1-10-8-11(2-3-13(10)14)16-5-4-12-9-15-6-7-17-12/h2-3,8,12,15-16H,4-7,9H2,1H3
InChIKeyHLUYPJAJUAAGJC-UHFFFAOYSA-N
XLogP1.92
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline 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

4-fluoro-3-methyl-N-[2-(oxolan-2-yl)ethyl]aniline
CID 63181207
N-(2-morpholin-2-ylethyl)pyridin-4-amine
CID 115239129
6-methyl-N-(2-morpholin-2-ylethyl)-1,3-benzodioxol-5-amine
CID 115239132
5-chloro-2-fluoro-N-(2-morpholin-2-ylethyl)benzamide
CID 117044843
(2R)-2-(4-fluoro-3-methylphenyl)morpholine
CID 94254202
2-[2-(5-chloro-2-fluorophenyl)ethyl]morpholine
CID 116868519
N-methyl-2-morpholin-2-ylethanamine
CID 14652595
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-morpholin-2-ylethanamine
CID 115239190
2-methyl-4-(morpholin-2-ylmethylamino)benzamide
CID 113287167
N-[(3-methylphenyl)methyl]-2-morpholin-2-ylethanamine
CID 115239213
4-fluoro-N-methyl-N-(2-morpholin-2-ylethyl)aniline
CID 66429418
3-fluoro-4-methyl-N-(morpholin-2-ylmethyl)benzamide
CID 43603078

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline?
The IUPAC name of 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline (CID 115239076) is 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline.
What is the SMILES notation for 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline?
The canonical SMILES for 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline is Cc1cc(NCCC2CNCCO2)ccc1F.
What is the InChIKey of 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline?
The InChIKey is HLUYPJAJUAAGJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-10-8-11(2-3-13(10)14)16-5-4-12-9-15-6-7-17-12/h2-3,8,12,15-16H,4-7,9H2,1H3.
What are the key properties of 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline?
4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline has a molecular weight of 238.31 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-methyl-N-(2-morpholin-2-ylethyl)aniline is sourced from PubChem (CID 115239076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).