4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine

C20H40N2O6 — CID 59956194

IUPAC4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine
SMILESCNC1C(C)OC(COC2OC(COC)C(C)C(OC)C2NC)C(C)C1OC
InChIInChI=1S/C20H40N2O6/c1-11-14(9-23-6)28-20(17(22-5)19(11)25-8)26-10-15-12(2)18(24-7)16(21-4)13(3)27-15/h11-22H,9-10H2,1-8H3
InChIKeyAKMWUZADBYGWFC-UHFFFAOYSA-N
MW404.55 g/mol
LogP0.64
Rot. Bonds9

About 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine

4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine (PubChem CID 59956194) has the molecular formula C20H40N2O6 and a molecular weight of 404.55 g/mol. Its IUPAC name is 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine.

Molecular Properties

Compound Name4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine
PubChem CID59956194
Molecular FormulaC20H40N2O6
Molecular Weight404.55 g/mol
Exact Mass404.29
IUPAC Name4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine
SMILESCNC1C(C)OC(COC2OC(COC)C(C)C(OC)C2NC)C(C)C1OC
InChIInChI=1S/C20H40N2O6/c1-11-14(9-23-6)28-20(17(22-5)19(11)25-8)26-10-15-12(2)18(24-7)16(21-4)13(3)27-15/h11-22H,9-10H2,1-8H3
InChIKeyAKMWUZADBYGWFC-UHFFFAOYSA-N
XLogP0.64
TPSA79.44 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.55
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

(2R,4S,5R)-2,3,4-trimethoxy-6-(methoxymethyl)-5-methyloxane
CID 176646378
2,3-dimethoxy-6-(methoxymethyl)-5-methyloxan-4-ol
CID 76704011
(3R,5S,6S)-3-methoxy-2-(methoxymethyl)-4,5,6-trimethyloxane
CID 71166951
(2R,4R,5R)-3,4-dimethoxy-2-(methoxymethyl)-5-methyloxolane
CID 174068913
(3R,4R,6S)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[(2R,4S,5S)-4-methoxy-6-(methoxymethyl)-3,5-dimethyloxan-2-yl]oxymethyl]-5,6-dimethyloxan-3-ol
CID 91006613
2-amino-N-[(4R,5R)-4,5-dimethoxy-6-(methoxymethyl)-2-methyloxan-3-yl]acetamide
CID 58679026
2-(methoxymethyl)-3,4,5-trimethyloxolane
CID 21349670
(2R,3R,4S,5S,6R)-2,3,4,5-tetramethoxy-6-(methoxymethyl)oxane
CID 12900878
3,4,5-trimethoxy-2-(methoxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane
CID 91701485
[(2S,3R,4S,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl] acetate
CID 14447784
(2R,3R,4S,5R,6R)-3,5-dimethoxy-2-(methoxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxy-6-[(2R,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane
CID 24744907
2-[(5-aminooxy-3,4-dihydroxy-6-methyloxan-2-yl)methoxy]-6-(methoxymethyl)oxane-3,4,5-triol
CID 154627433

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine?
The IUPAC name of 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine (CID 59956194) is 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine.
What is the SMILES notation for 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine?
The canonical SMILES for 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine is CNC1C(C)OC(COC2OC(COC)C(C)C(OC)C2NC)C(C)C1OC.
What is the InChIKey of 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine?
The InChIKey is AKMWUZADBYGWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40N2O6/c1-11-14(9-23-6)28-20(17(22-5)19(11)25-8)26-10-15-12(2)18(24-7)16(21-4)13(3)27-15/h11-22H,9-10H2,1-8H3.
What are the key properties of 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine?
4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine has a molecular weight of 404.55 g/mol, XLogP of 0.64, 9 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[[4-methoxy-3,6-dimethyl-5-(methylamino)oxan-2-yl]methoxy]-6-(methoxymethyl)-N,5-dimethyloxan-3-amine is sourced from PubChem (CID 59956194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).