2-ethoxy-1-(oxolan-3-yl)propan-1-amine

C9H19NO2 — CID 64541978

IUPAC2-ethoxy-1-(oxolan-3-yl)propan-1-amine
SMILESCCOC(C)C(N)C1CCOC1
InChIInChI=1S/C9H19NO2/c1-3-12-7(2)9(10)8-4-5-11-6-8/h7-9H,3-6,10H2,1-2H3
InChIKeyNQBVRBQGAJXMPZ-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.78
Rot. Bonds4

About 2-ethoxy-1-(oxolan-3-yl)propan-1-amine

2-ethoxy-1-(oxolan-3-yl)propan-1-amine (PubChem CID 64541978) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-ethoxy-1-(oxolan-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-1-(oxolan-3-yl)propan-1-amine
PubChem CID64541978
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-ethoxy-1-(oxolan-3-yl)propan-1-amine
SMILESCCOC(C)C(N)C1CCOC1
InChIInChI=1S/C9H19NO2/c1-3-12-7(2)9(10)8-4-5-11-6-8/h7-9H,3-6,10H2,1-2H3
InChIKeyNQBVRBQGAJXMPZ-UHFFFAOYSA-N
XLogP0.78
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethoxy-1-(oxolan-3-yl)propan-1-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 2-ethoxy-1-(oxolan-3-yl)propan-1-amine?
The IUPAC name of 2-ethoxy-1-(oxolan-3-yl)propan-1-amine (CID 64541978) is 2-ethoxy-1-(oxolan-3-yl)propan-1-amine.
What is the SMILES notation for 2-ethoxy-1-(oxolan-3-yl)propan-1-amine?
The canonical SMILES for 2-ethoxy-1-(oxolan-3-yl)propan-1-amine is CCOC(C)C(N)C1CCOC1.
What is the InChIKey of 2-ethoxy-1-(oxolan-3-yl)propan-1-amine?
The InChIKey is NQBVRBQGAJXMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-12-7(2)9(10)8-4-5-11-6-8/h7-9H,3-6,10H2,1-2H3.
What are the key properties of 2-ethoxy-1-(oxolan-3-yl)propan-1-amine?
2-ethoxy-1-(oxolan-3-yl)propan-1-amine has a molecular weight of 173.26 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(oxolan-3-yl)propan-1-amine is sourced from PubChem (CID 64541978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).