N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide

C13H25NO6 — CID 11130066

IUPACN-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide
SMILESCOC[C@H]1O[C@@H](OC)[C@H](N(C)C(C)=O)[C@@H](OC)[C@H]1OC
InChIInChI=1S/C13H25NO6/c1-8(15)14(2)10-12(18-5)11(17-4)9(7-16-3)20-13(10)19-6/h9-13H,7H2,1-6H3/t9-,10-,11+,12-,13-/m1/s1
InChIKeyLLBFFWSIFJDSHK-UJPOAAIJSA-N
MW291.34 g/mol
LogP-0.12
Rot. Bonds6

About N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide

N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide (PubChem CID 11130066) has the molecular formula C13H25NO6 and a molecular weight of 291.34 g/mol. Its IUPAC name is N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide
PubChem CID11130066
Molecular FormulaC13H25NO6
Molecular Weight291.34 g/mol
Exact Mass291.17
IUPAC NameN-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide
SMILESCOC[C@H]1O[C@@H](OC)[C@H](N(C)C(C)=O)[C@@H](OC)[C@H]1OC
InChIInChI=1S/C13H25NO6/c1-8(15)14(2)10-12(18-5)11(17-4)9(7-16-3)20-13(10)19-6/h9-13H,7H2,1-6H3/t9-,10-,11+,12-,13-/m1/s1
InChIKeyLLBFFWSIFJDSHK-UJPOAAIJSA-N
XLogP-0.12
TPSA66.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.34
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide with MolForge

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Related Compounds

[3-[acetyl(methyl)amino]-2,5-dimethoxy-6-(methoxymethyl)oxan-4-yl] acetate
CID 575303
2,4,5-trimethoxy-6-(methoxymethyl)-N,N-dimethyloxan-3-amine
CID 568194
[(2S,3R,4S,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl] acetate
CID 14447784
N-[(2R,3S,4R,5R,6R)-2-methoxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl]-N-methylacetamide
CID 163976922
[(2R,3R,4S,5S,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl] acetate
CID 23253170
N-(6-ethyl-2-methoxy-4,5-dimethyloxan-3-yl)-N-methylacetamide
CID 58298704
(2R,3R,4S,5S,6R)-2,3,4,5-tetramethoxy-6-(methoxymethyl)oxane
CID 12900878
[(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-2-(methoxymethyl)oxan-3-yl] acetate
CID 91751777
[(2S,3R,4R,5S)-4,5,6-triacetyloxy-2-(methoxymethyl)oxan-3-yl] acetate
CID 131709256
3,4,5-trimethoxy-2-(methoxymethyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxyoxane
CID 91701485
(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
(3R,4R,5S,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-amine
CID 24804009

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide?
The IUPAC name of N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide (CID 11130066) is N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide.
What is the SMILES notation for N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide?
The canonical SMILES for N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide is COC[C@H]1O[C@@H](OC)[C@H](N(C)C(C)=O)[C@@H](OC)[C@H]1OC.
What is the InChIKey of N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide?
The InChIKey is LLBFFWSIFJDSHK-UJPOAAIJSA-N. The full InChI is InChI=1S/C13H25NO6/c1-8(15)14(2)10-12(18-5)11(17-4)9(7-16-3)20-13(10)19-6/h9-13H,7H2,1-6H3/t9-,10-,11+,12-,13-/m1/s1.
What are the key properties of N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide?
N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide has a molecular weight of 291.34 g/mol, XLogP of -0.12, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2R,3R,4R,5R,6R)-2,4,5-trimethoxy-6-(methoxymethyl)oxan-3-yl]acetamide is sourced from PubChem (CID 11130066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).