2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline

C12H17FN2O — CID 115111854

IUPAC2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline
SMILESCN(C)c1c(F)cccc1C1CNCCO1
InChIInChI=1S/C12H17FN2O/c1-15(2)12-9(4-3-5-10(12)13)11-8-14-6-7-16-11/h3-5,11,14H,6-8H2,1-2H3
InChIKeyCLAUIOPZNDVFFX-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.55
Rot. Bonds2

About 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline

2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline (PubChem CID 115111854) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline.

Molecular Properties

Compound Name2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline
PubChem CID115111854
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline
SMILESCN(C)c1c(F)cccc1C1CNCCO1
InChIInChI=1S/C12H17FN2O/c1-15(2)12-9(4-3-5-10(12)13)11-8-14-6-7-16-11/h3-5,11,14H,6-8H2,1-2H3
InChIKeyCLAUIOPZNDVFFX-UHFFFAOYSA-N
XLogP1.55
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoro-4-methylphenyl)morpholine
CID 83698750
(2R)-2-(2,4-difluorophenyl)morpholine
CID 93302359
2-[2,3-bis(methylsulfanyl)phenyl]morpholine
CID 117391940
2,3-difluoro-6-morpholin-2-ylphenol
CID 84783760
2-[2-(1,1-difluoroethyl)phenyl]morpholine
CID 117326792
2-(2-fluoro-5-methylsulfanylphenyl)morpholine
CID 115111871
2-(2-chloro-3,6-difluorophenyl)morpholine
CID 117339537
2-(2-bromo-4-fluorophenyl)morpholine
CID 83734450
2-(3-fluoro-4-methylphenyl)morpholine
CID 65122034
(3-fluoro-4-morpholin-2-ylphenyl)boronic acid
CID 175210838
2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine
CID 117350776
2-chloro-3-fluoro-4-morpholin-2-ylphenol
CID 117335357

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline?
The IUPAC name of 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline (CID 115111854) is 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline.
What is the SMILES notation for 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline?
The canonical SMILES for 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline is CN(C)c1c(F)cccc1C1CNCCO1.
What is the InChIKey of 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline?
The InChIKey is CLAUIOPZNDVFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-15(2)12-9(4-3-5-10(12)13)11-8-14-6-7-16-11/h3-5,11,14H,6-8H2,1-2H3.
What are the key properties of 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline?
2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline has a molecular weight of 224.28 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N-dimethyl-6-morpholin-2-ylaniline is sourced from PubChem (CID 115111854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).