3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol

C10H21NO3 — CID 70840318

IUPAC3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol
SMILESCCC1C(C)OC(COC)C(N)C1O
InChIInChI=1S/C10H21NO3/c1-4-7-6(2)14-8(5-13-3)9(11)10(7)12/h6-10,12H,4-5,11H2,1-3H3
InChIKeyAPFXHLKQVPLHDS-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.13
Rot. Bonds3

About 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol

3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol (PubChem CID 70840318) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol.

Molecular Properties

Compound Name3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol
PubChem CID70840318
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol
SMILESCCC1C(C)OC(COC)C(N)C1O
InChIInChI=1S/C10H21NO3/c1-4-7-6(2)14-8(5-13-3)9(11)10(7)12/h6-10,12H,4-5,11H2,1-3H3
InChIKeyAPFXHLKQVPLHDS-UHFFFAOYSA-N
XLogP0.13
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,4S,6R)-5-amino-2-(hydroxymethyl)-3,6-bis(methoxymethyl)oxan-4-ol
CID 59707793
3-amino-2-ethyl-6-(hydroxymethyl)-5-(methoxymethyl)oxan-4-ol
CID 58884401
3-amino-2-[[5-amino-4-hydroxy-2-(hydroxymethyl)-6-(methoxymethyl)oxan-3-yl]methoxymethyl]-6-(hydroxymethyl)-5-(methoxymethyl)oxan-4-ol
CID 59069030
(2R,4R,6R)-5-amino-2-ethyl-4,6-dimethyloxan-3-ol
CID 59870886
2-(methoxymethyl)-3,4,5-trimethyloxolane
CID 21349670
[4-acetyloxy-5-hydroxy-2-(methoxymethyl)-6-methyloxan-3-yl] acetate
CID 129093778
(4R,5S)-2-(hydroxymethyl)-6-(methoxymethyl)-4-methyloxane-3,5-diol
CID 90293180
(2R,3S,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane;(2S,4R,5R)-4-methoxy-5-(methoxymethyl)-2-methyloxolan-3-ol
CID 158901360
(2R,4R,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane;(2S,3R,5R)-4-methoxy-5-(methoxymethyl)-2-methyloxolan-3-ol
CID 158901361
(3R,6R)-5-amino-2-ethyl-6-methoxy-3-methyloxan-4-ol
CID 163469681
(2R,3S,4R,5S)-2-ethyl-5-methyloxolane-3,4-diol
CID 59834182
(2R,4S,5S)-2-ethyl-5-methyloxolane-3,4-diol
CID 59996451

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol?
The IUPAC name of 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol (CID 70840318) is 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol.
What is the SMILES notation for 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol?
The canonical SMILES for 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol is CCC1C(C)OC(COC)C(N)C1O.
What is the InChIKey of 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol?
The InChIKey is APFXHLKQVPLHDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-4-7-6(2)14-8(5-13-3)9(11)10(7)12/h6-10,12H,4-5,11H2,1-3H3.
What are the key properties of 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol?
3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol has a molecular weight of 203.28 g/mol, XLogP of 0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-ethyl-2-(methoxymethyl)-6-methyloxan-4-ol is sourced from PubChem (CID 70840318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).