5-methoxy-2-methyloxolan-3-amine

C6H13NO2 — CID 163994899

IUPAC5-methoxy-2-methyloxolan-3-amine
SMILESCOC1CC(N)C(C)O1
InChIInChI=1S/C6H13NO2/c1-4-5(7)3-6(8-2)9-4/h4-6H,3,7H2,1-2H3
InChIKeyUDVHWLCBZBPDCV-UHFFFAOYSA-N
MW131.17 g/mol
LogP0.09
Rot. Bonds1

About 5-methoxy-2-methyloxolan-3-amine

5-methoxy-2-methyloxolan-3-amine (PubChem CID 163994899) has the molecular formula C6H13NO2 and a molecular weight of 131.17 g/mol. Its IUPAC name is 5-methoxy-2-methyloxolan-3-amine.

Molecular Properties

Compound Name5-methoxy-2-methyloxolan-3-amine
PubChem CID163994899
Molecular FormulaC6H13NO2
Molecular Weight131.17 g/mol
Exact Mass131.09
IUPAC Name5-methoxy-2-methyloxolan-3-amine
SMILESCOC1CC(N)C(C)O1
InChIInChI=1S/C6H13NO2/c1-4-5(7)3-6(8-2)9-4/h4-6H,3,7H2,1-2H3
InChIKeyUDVHWLCBZBPDCV-UHFFFAOYSA-N
XLogP0.09
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R,4S)-4-amino-6-methoxy-2-methyloxan-3-ol
CID 70527934
(2S,3S,6R)-6-methoxy-2-methyloxan-3-amine
CID 55284490
(2R,3R,4S,6S)-3-amino-6-methoxy-2-methyloxan-4-ol
CID 130909200
(1R)-1-[(2R,3R,5R)-3-amino-5-methoxyoxolan-2-yl]ethanol
CID 131124380
(2S,3R,6R)-6-methoxy-2-methyloxan-3-amine;propane-2,2-diol
CID 176998974
(2R,3S,5R)-2-(aminomethyl)-5-methoxyoxolan-3-amine
CID 131848824
(2R,3S,5R)-2-[(1S)-1-aminoethyl]-5-methoxyoxolan-3-amine
CID 130949398
(1R,2S,4R,6S)-4-methoxy-2-methyl-3,7-dioxabicyclo[4.1.0]heptane
CID 131885979
(2S,3R,4S,6S)-6-methoxy-2-methyloxane-3,4-diol
CID 12775768
(1R,2R,4R,6S)-4-methoxy-2-methyl-3,7-dioxabicyclo[4.1.0]heptane
CID 12817977
6-methoxy-2,4-dimethyloxan-3-ol
CID 58831559
(2S,3S,5R)-5-methoxy-2-methyloxolane-3-carbaldehyde
CID 93496295

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyloxolan-3-amine?
The IUPAC name of 5-methoxy-2-methyloxolan-3-amine (CID 163994899) is 5-methoxy-2-methyloxolan-3-amine.
What is the SMILES notation for 5-methoxy-2-methyloxolan-3-amine?
The canonical SMILES for 5-methoxy-2-methyloxolan-3-amine is COC1CC(N)C(C)O1.
What is the InChIKey of 5-methoxy-2-methyloxolan-3-amine?
The InChIKey is UDVHWLCBZBPDCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-4-5(7)3-6(8-2)9-4/h4-6H,3,7H2,1-2H3.
What are the key properties of 5-methoxy-2-methyloxolan-3-amine?
5-methoxy-2-methyloxolan-3-amine has a molecular weight of 131.17 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyloxolan-3-amine is sourced from PubChem (CID 163994899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).