2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine

C10H21NO2 — CID 103489370

IUPAC2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COC(C)COCC
InChIInChI=1S/C10H21NO2/c1-5-12-8-10(3)13-7-9(2)6-11-4/h10-11H,2,5-8H2,1,3-4H3
InChIKeyUEVISKFAXBAUDA-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.20
Rot. Bonds8

About 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine

2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine (PubChem CID 103489370) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine
PubChem CID103489370
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COC(C)COCC
InChIInChI=1S/C10H21NO2/c1-5-12-8-10(3)13-7-9(2)6-11-4/h10-11H,2,5-8H2,1,3-4H3
InChIKeyUEVISKFAXBAUDA-UHFFFAOYSA-N
XLogP1.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine?
The IUPAC name of 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine (CID 103489370) is 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine.
What is the SMILES notation for 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine?
The canonical SMILES for 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine is C=C(CNC)COC(C)COCC.
What is the InChIKey of 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine?
The InChIKey is UEVISKFAXBAUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-5-12-8-10(3)13-7-9(2)6-11-4/h10-11H,2,5-8H2,1,3-4H3.
What are the key properties of 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine?
2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine has a molecular weight of 187.28 g/mol, XLogP of 1.20, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxypropan-2-yloxymethyl)-N-methylprop-2-en-1-amine is sourced from PubChem (CID 103489370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).