5-methoxyoxan-3-amine

C6H13NO2 — CID 55285651

IUPAC5-methoxyoxan-3-amine
SMILESCOC1COCC(N)C1
InChIInChI=1S/C6H13NO2/c1-8-6-2-5(7)3-9-4-6/h5-6H,2-4,7H2,1H3
InChIKeyGASZBOLOXZFEKH-UHFFFAOYSA-N
MW131.17 g/mol
LogP-0.25
Rot. Bonds1

About 5-methoxyoxan-3-amine

5-methoxyoxan-3-amine (PubChem CID 55285651) has the molecular formula C6H13NO2 and a molecular weight of 131.17 g/mol. Its IUPAC name is 5-methoxyoxan-3-amine.

Molecular Properties

Compound Name5-methoxyoxan-3-amine
PubChem CID55285651
Molecular FormulaC6H13NO2
Molecular Weight131.17 g/mol
Exact Mass131.09
IUPAC Name5-methoxyoxan-3-amine
SMILESCOC1COCC(N)C1
InChIInChI=1S/C6H13NO2/c1-8-6-2-5(7)3-9-4-6/h5-6H,2-4,7H2,1H3
InChIKeyGASZBOLOXZFEKH-UHFFFAOYSA-N
XLogP-0.25
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 ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methoxyoxan-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methoxyoxan-3-amine?
The IUPAC name of 5-methoxyoxan-3-amine (CID 55285651) is 5-methoxyoxan-3-amine.
What is the SMILES notation for 5-methoxyoxan-3-amine?
The canonical SMILES for 5-methoxyoxan-3-amine is COC1COCC(N)C1.
What is the InChIKey of 5-methoxyoxan-3-amine?
The InChIKey is GASZBOLOXZFEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-8-6-2-5(7)3-9-4-6/h5-6H,2-4,7H2,1H3.
What are the key properties of 5-methoxyoxan-3-amine?
5-methoxyoxan-3-amine has a molecular weight of 131.17 g/mol, XLogP of -0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxyoxan-3-amine is sourced from PubChem (CID 55285651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).