(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine

C16H20N2O2 — CID 118006697

IUPAC(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine
SMILESCOc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c2cccnc12
InChIInChI=1S/C16H20N2O2/c1-11-9-18(10-12(2)20-11)14-6-7-15(19-3)16-13(14)5-4-8-17-16/h4-8,11-12H,9-10H2,1-3H3/t11-,12+
InChIKeyHXKFVVSVGBWHHW-TXEJJXNPSA-N
MW272.35 g/mol
LogP2.86
Rot. Bonds2

About (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine

(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine (PubChem CID 118006697) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine
PubChem CID118006697
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine
SMILESCOc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c2cccnc12
InChIInChI=1S/C16H20N2O2/c1-11-9-18(10-12(2)20-11)14-6-7-15(19-3)16-13(14)5-4-8-17-16/h4-8,11-12H,9-10H2,1-3H3/t11-,12+
InChIKeyHXKFVVSVGBWHHW-TXEJJXNPSA-N
XLogP2.86
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

8-methoxy-5-piperidin-1-ylquinoline
CID 86218648
8-(2,6-dimethylmorpholin-4-yl)quinolin-5-amine
CID 43450053
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinolin-8-amine
CID 104957764
2-hydroxy-N-[(3R,5S)-1-(8-methoxyquinolin-5-yl)-5-methylpiperidin-3-yl]-3-methylbutanamide
CID 166770237
methyl (2R,6R)-6-methyl-4-[8-(trifluoromethyl)quinolin-5-yl]morpholine-2-carboxylate
CID 156648946
4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168699530
4-hydroxy-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168702268
N-[(3R,5S)-1-(8-methoxyquinolin-5-yl)-5-methylpiperidin-3-yl]-3,3-dimethylbutanamide
CID 129240952
5-[(2S,6S)-2-(hydroxymethyl)-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118006633
(2S,6S)-4-(8-methoxy-4-methylquinolin-2-yl)-2,6-dimethylmorpholine
CID 27271146
(2R,6R)-4-(8-methoxy-4-methylquinolin-2-yl)-2,6-dimethylmorpholine
CID 27271148
5-[(2R,6R)-2-(1-hydroxypropyl)-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118007097

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine?
The IUPAC name of (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine (CID 118006697) is (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine.
What is the SMILES notation for (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine?
The canonical SMILES for (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine is COc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c2cccnc12.
What is the InChIKey of (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine?
The InChIKey is HXKFVVSVGBWHHW-TXEJJXNPSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-9-18(10-12(2)20-11)14-6-7-15(19-3)16-13(14)5-4-8-17-16/h4-8,11-12H,9-10H2,1-3H3/t11-,12+.
What are the key properties of (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine?
(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine has a molecular weight of 272.35 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine is sourced from PubChem (CID 118006697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).