3-ethoxyoxan-4-amine

C7H15NO2 — CID 43608859

IUPAC3-ethoxyoxan-4-amine
SMILESCCOC1COCCC1N
InChIInChI=1S/C7H15NO2/c1-2-10-7-5-9-4-3-6(7)8/h6-7H,2-5,8H2,1H3
InChIKeyBRHMISIZVJYWHH-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.14
Rot. Bonds2

About 3-ethoxyoxan-4-amine

3-ethoxyoxan-4-amine (PubChem CID 43608859) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 3-ethoxyoxan-4-amine.

Molecular Properties

Compound Name3-ethoxyoxan-4-amine
PubChem CID43608859
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name3-ethoxyoxan-4-amine
SMILESCCOC1COCCC1N
InChIInChI=1S/C7H15NO2/c1-2-10-7-5-9-4-3-6(7)8/h6-7H,2-5,8H2,1H3
InChIKeyBRHMISIZVJYWHH-UHFFFAOYSA-N
XLogP0.14
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethoxyoxan-4-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 3-ethoxyoxan-4-amine?
The IUPAC name of 3-ethoxyoxan-4-amine (CID 43608859) is 3-ethoxyoxan-4-amine.
What is the SMILES notation for 3-ethoxyoxan-4-amine?
The canonical SMILES for 3-ethoxyoxan-4-amine is CCOC1COCCC1N.
What is the InChIKey of 3-ethoxyoxan-4-amine?
The InChIKey is BRHMISIZVJYWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-2-10-7-5-9-4-3-6(7)8/h6-7H,2-5,8H2,1H3.
What are the key properties of 3-ethoxyoxan-4-amine?
3-ethoxyoxan-4-amine has a molecular weight of 145.20 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxyoxan-4-amine is sourced from PubChem (CID 43608859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).