3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine

C11H23NO2 — CID 63738389

IUPAC3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine
SMILESCCOCCCNCC1CCCOC1
InChIInChI=1S/C11H23NO2/c1-2-13-8-4-6-12-9-11-5-3-7-14-10-11/h11-12H,2-10H2,1H3
InChIKeyUHVFYKLRLCAZHR-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.43
Rot. Bonds7

About 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine

3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine (PubChem CID 63738389) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine
PubChem CID63738389
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine
SMILESCCOCCCNCC1CCCOC1
InChIInChI=1S/C11H23NO2/c1-2-13-8-4-6-12-9-11-5-3-7-14-10-11/h11-12H,2-10H2,1H3
InChIKeyUHVFYKLRLCAZHR-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-ethoxy-N-(oxan-3-ylmethyl)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

Related Compounds

N-(oxan-3-ylmethyl)butan-1-amine
CID 61020591
N-(oxan-3-ylmethyl)-2-propoxyethanamine
CID 106451725
N-(oxan-3-ylmethyl)nonan-1-amine
CID 61020606
3-fluoro-N-(oxan-3-ylmethyl)propan-1-amine
CID 81105564
2-(2-methylprop-2-enoxy)-N-(oxan-3-ylmethyl)ethanamine
CID 115908252
3-methoxy-N-(oxolan-3-ylmethyl)propan-1-amine
CID 43205123
N-(oxan-3-ylmethyl)-3-phenoxypropan-1-amine
CID 62935741
1-cyclopentyl-N-(oxan-3-ylmethyl)methanamine
CID 61342622
1-[(3S)-oxan-3-yl]-N-[[(3S)-oxan-3-yl]methyl]methanamine
CID 129371205
3-ethoxy-N-(oxolan-2-ylmethyl)propan-1-amine
CID 43180080
N-methyl-4-(oxan-3-ylmethylamino)butanamide
CID 63890126
N',N'-diethyl-N-[[(3R)-oxan-3-yl]methyl]ethane-1,2-diamine
CID 93449849

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine?
The IUPAC name of 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine (CID 63738389) is 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine?
The canonical SMILES for 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine is CCOCCCNCC1CCCOC1.
What is the InChIKey of 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine?
The InChIKey is UHVFYKLRLCAZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-2-13-8-4-6-12-9-11-5-3-7-14-10-11/h11-12H,2-10H2,1H3.
What are the key properties of 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine?
3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 63738389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).