4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine

C15H19N3O — CID 104957764

IUPAC4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine
SMILESC[C@@H]1CN(c2ccnc3c(N)cccc23)C[C@H](C)O1
InChIInChI=1S/C15H19N3O/c1-10-8-18(9-11(2)19-10)14-6-7-17-15-12(14)4-3-5-13(15)16/h3-7,10-11H,8-9,16H2,1-2H3/t10-,11+
InChIKeyQJESFFSEVLUERY-PHIMTYICSA-N
MW257.34 g/mol
LogP2.43
Rot. Bonds1

About 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine

4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine (PubChem CID 104957764) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine.

Molecular Properties

Compound Name4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine
PubChem CID104957764
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine
SMILESC[C@@H]1CN(c2ccnc3c(N)cccc23)C[C@H](C)O1
InChIInChI=1S/C15H19N3O/c1-10-8-18(9-11(2)19-10)14-6-7-17-15-12(14)4-3-5-13(15)16/h3-7,10-11H,8-9,16H2,1-2H3/t10-,11+
InChIKeyQJESFFSEVLUERY-PHIMTYICSA-N
XLogP2.43
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

8-(2,6-dimethylmorpholin-4-yl)quinolin-5-amine
CID 43450053
4-(2,5-dimethylmorpholin-4-yl)quinolin-8-amine
CID 83060956
(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine
CID 118006697
4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine
CID 83061254
4-thiomorpholin-4-ylquinolin-8-amine
CID 83058354
4-[4-(trifluoromethyl)piperidin-1-yl]quinolin-8-amine
CID 83066187
4-(2-methylazepan-1-yl)quinolin-8-amine
CID 83060900
3-chloro-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]aniline
CID 30044459
methyl (2R,6R)-6-methyl-4-[8-(trifluoromethyl)quinolin-5-yl]morpholine-2-carboxylate
CID 156648946
5-[(2R,6R)-2-methyl-6-propanoylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118006562
5-[(2S,6S)-2-(hydroxymethyl)-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118006633
5-[4-(dimethylamino)piperidin-1-yl]quinolin-8-amine
CID 43585725

Frequently Asked Questions

What is the IUPAC name of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine?
The IUPAC name of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine (CID 104957764) is 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine.
What is the SMILES notation for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine?
The canonical SMILES for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine is C[C@@H]1CN(c2ccnc3c(N)cccc23)C[C@H](C)O1.
What is the InChIKey of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine?
The InChIKey is QJESFFSEVLUERY-PHIMTYICSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-8-18(9-11(2)19-10)14-6-7-17-15-12(14)4-3-5-13(15)16/h3-7,10-11H,8-9,16H2,1-2H3/t10-,11+.
What are the key properties of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine?
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine has a molecular weight of 257.34 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine is sourced from PubChem (CID 104957764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).