2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine

C9H19NO2 — CID 103074376

IUPAC2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCCOCC
InChIInChI=1S/C9H19NO2/c1-4-11-5-6-12-8-9(2)7-10-3/h10H,2,4-8H2,1,3H3
InChIKeyOBJLIDBXQZENJY-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.82
Rot. Bonds8

About 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine

2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine (PubChem CID 103074376) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine
PubChem CID103074376
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCCOCC
InChIInChI=1S/C9H19NO2/c1-4-11-5-6-12-8-9(2)7-10-3/h10H,2,4-8H2,1,3H3
InChIKeyOBJLIDBXQZENJY-UHFFFAOYSA-N
XLogP0.82
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.82
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'}

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Related Compounds

N-methyl-2-[2-(2-methylprop-2-enoxy)ethoxy]ethanamine
CID 88262803
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
N-ethyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074315
2-(prop-2-enoxymethyl)-N-propylprop-2-en-1-amine
CID 103074319
N-methyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074321
2-(methoxymethyl)-N-propylprop-2-en-1-amine
CID 103074360
2-(methoxymethyl)-N-methylprop-2-en-1-amine
CID 103074362
2-(ethoxymethyl)-N-ethylprop-2-en-1-amine
CID 103074363
2-(ethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074365
N-tert-butyl-2-(ethoxymethyl)prop-2-en-1-amine
CID 103074366

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine?
The IUPAC name of 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine (CID 103074376) is 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine.
What is the SMILES notation for 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine?
The canonical SMILES for 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine is C=C(CNC)COCCOCC.
What is the InChIKey of 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine?
The InChIKey is OBJLIDBXQZENJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-11-5-6-12-8-9(2)7-10-3/h10H,2,4-8H2,1,3H3.
What are the key properties of 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine?
2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine has a molecular weight of 173.26 g/mol, XLogP of 0.82, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine is sourced from PubChem (CID 103074376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).