2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine

C11H23NO2 — CID 103074372

IUPAC2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
SMILESC=C(CNC(C)C)COCCOCC
InChIInChI=1S/C11H23NO2/c1-5-13-6-7-14-9-11(4)8-12-10(2)3/h10,12H,4-9H2,1-3H3
InChIKeyLXAAIPQSHUXWCL-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.59
Rot. Bonds9

About 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine

2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine (PubChem CID 103074372) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
PubChem CID103074372
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
SMILESC=C(CNC(C)C)COCCOCC
InChIInChI=1S/C11H23NO2/c1-5-13-6-7-14-9-11(4)8-12-10(2)3/h10,12H,4-9H2,1-3H3
InChIKeyLXAAIPQSHUXWCL-UHFFFAOYSA-N
XLogP1.59
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-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-propan-2-yl-2-(2,2,2-trifluoroethoxymethyl)prop-2-en-1-amine
CID 103074344
2-(2,2-difluoroethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103075028
N-propan-2-yl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075056
N-methyl-2-[3-(methylamino)propoxymethyl]prop-2-en-1-amine
CID 89501895
3-(2-methylprop-2-enoxy)-N-prop-2-enylpropan-1-amine
CID 142038525
N-methyl-3-(2-methylprop-2-enoxy)propan-1-amine
CID 163401473
3-(3-methylbut-2-enoxy)-N-propan-2-ylpropan-1-amine
CID 62342601
3-(2-methylprop-2-enoxy)-N-propan-2-ylpropan-1-amine
CID 62342603
3-(2-methylidenebutoxy)-N-propan-2-ylpropan-1-amine
CID 66045505
N-ethyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074315
N-propan-2-yl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074317
N-tert-butyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074318

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine?
The IUPAC name of 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine (CID 103074372) is 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine.
What is the SMILES notation for 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine?
The canonical SMILES for 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine is C=C(CNC(C)C)COCCOCC.
What is the InChIKey of 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine?
The InChIKey is LXAAIPQSHUXWCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-5-13-6-7-14-9-11(4)8-12-10(2)3/h10,12H,4-9H2,1-3H3.
What are the key properties of 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine?
2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.59, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine is sourced from PubChem (CID 103074372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).