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

C11H23NO2 — CID 103074374

IUPAC2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine
SMILESC=C(CNCCC)COCCOCC
InChIInChI=1S/C11H23NO2/c1-4-6-12-9-11(3)10-14-8-7-13-5-2/h12H,3-10H2,1-2H3
InChIKeyPXACNZCDCROZNU-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.60
Rot. Bonds10

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

2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine (PubChem CID 103074374) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine
PubChem CID103074374
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine
SMILESC=C(CNCCC)COCCOCC
InChIInChI=1S/C11H23NO2/c1-4-6-12-9-11(3)10-14-8-7-13-5-2/h12H,3-10H2,1-2H3
InChIKeyPXACNZCDCROZNU-UHFFFAOYSA-N
XLogP1.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.60
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-propyl-2-(2,2,2-trifluoroethoxymethyl)prop-2-en-1-amine
CID 103074346
2-(2,2-difluoroethoxymethyl)-N-propylprop-2-en-1-amine
CID 103075031
N-ethyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075053
N-propyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075059
N-methyl-2-[2-(2-methylprop-2-enoxy)ethoxy]ethanamine
CID 88262803
1-(2-methylprop-2-enoxy)-N-[1-(2-methylprop-2-enoxy)ethyl]ethanamine
CID 88445841
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-(3-ethoxypropyl)-2-methylprop-2-en-1-amine
CID 60689898
N-[2-(2-methoxyethoxy)ethyl]-2-methylprop-2-en-1-amine
CID 62331546
3-(2-methylprop-2-enoxy)-N-propan-2-ylpropan-1-amine
CID 62342603

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine?
The IUPAC name of 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine (CID 103074374) is 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine.
What is the SMILES notation for 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine?
The canonical SMILES for 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine is C=C(CNCCC)COCCOCC.
What is the InChIKey of 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine?
The InChIKey is PXACNZCDCROZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-4-6-12-9-11(3)10-14-8-7-13-5-2/h12H,3-10H2,1-2H3.
What are the key properties of 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine?
2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.60, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine is sourced from PubChem (CID 103074374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).