(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine

C12H16F2N2O — CID 30115194

IUPAC(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine
SMILESNC[C@@H](c1c(F)cccc1F)N1CCOCC1
InChIInChI=1S/C12H16F2N2O/c13-9-2-1-3-10(14)12(9)11(8-15)16-4-6-17-7-5-16/h1-3,11H,4-8,15H2/t11-/m0/s1
InChIKeyNUHFWVQMJUJGBF-NSHDSACASA-N
MW242.27 g/mol
LogP1.30
Rot. Bonds3

About (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine

(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine (PubChem CID 30115194) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine.

Molecular Properties

Compound Name(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine
PubChem CID30115194
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine
SMILESNC[C@@H](c1c(F)cccc1F)N1CCOCC1
InChIInChI=1S/C12H16F2N2O/c13-9-2-1-3-10(14)12(9)11(8-15)16-4-6-17-7-5-16/h1-3,11H,4-8,15H2/t11-/m0/s1
InChIKeyNUHFWVQMJUJGBF-NSHDSACASA-N
XLogP1.30
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-difluorophenyl)-2-pyrrolidin-1-ylethanamine
CID 16791427
2-(2,3-difluorophenyl)-2-(1,4-oxazepan-4-yl)ethanamine
CID 55234530
2-(4-cyclopropylpiperazin-1-yl)-2-(2,6-difluorophenyl)ethanamine
CID 61440571
2-(azepan-1-yl)-2-(2-chloro-6-fluorophenyl)ethanamine
CID 16789934
2-(2,4-difluorophenyl)-2-morpholin-4-ylethanamine;hydrochloride
CID 46736564
2-(2-bromo-5-fluorophenyl)-2-morpholin-4-ylethanamine
CID 114077681
3-(2,5-difluorophenyl)-3-morpholin-4-ylpropan-1-amine
CID 69312368
2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine
CID 82301212
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2-(2,6-difluorophenyl)ethanamine
CID 63150024
2-(2-ethylphenyl)-2-morpholin-4-ylethanamine
CID 62392799
2-(2-chloro-6-fluorophenyl)-2-(4,4-dimethylazepan-1-yl)ethanamine
CID 65283784
2-(2-chloro-6-fluorophenyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 63157457

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine?
The IUPAC name of (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine (CID 30115194) is (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine.
What is the SMILES notation for (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine?
The canonical SMILES for (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine is NC[C@@H](c1c(F)cccc1F)N1CCOCC1.
What is the InChIKey of (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine?
The InChIKey is NUHFWVQMJUJGBF-NSHDSACASA-N. The full InChI is InChI=1S/C12H16F2N2O/c13-9-2-1-3-10(14)12(9)11(8-15)16-4-6-17-7-5-16/h1-3,11H,4-8,15H2/t11-/m0/s1.
What are the key properties of (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine?
(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine has a molecular weight of 242.27 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine is sourced from PubChem (CID 30115194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).