N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine

C11H21NO2 — CID 103074461

IUPACN-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
SMILESC=C(CNCC)COCC1CCCO1
InChIInChI=1S/C11H21NO2/c1-3-12-7-10(2)8-13-9-11-5-4-6-14-11/h11-12H,2-9H2,1H3
InChIKeyWVUAFXLWELKCIT-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.35
Rot. Bonds7

About N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine

N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine (PubChem CID 103074461) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
PubChem CID103074461
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
SMILESC=C(CNCC)COCC1CCCO1
InChIInChI=1S/C11H21NO2/c1-3-12-7-10(2)8-13-9-11-5-4-6-14-11/h11-12H,2-9H2,1H3
InChIKeyWVUAFXLWELKCIT-UHFFFAOYSA-N
XLogP1.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclopentyloxymethyl)-N-ethylprop-2-en-1-amine
CID 103074329
2-(cyclopentyloxymethyl)-N-propylprop-2-en-1-amine
CID 103074333
N-ethyl-2-(oxan-2-ylmethoxymethyl)prop-2-en-1-amine
CID 103074447
2-(oxan-2-ylmethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074451
N-ethyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine
CID 103074454
2-(2-propan-2-yloxyethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074458
N-[2-(oxolan-2-ylmethoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074462
2-(oxolan-2-ylmethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074463
N-tert-butyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
CID 103074464
2-(oxolan-2-ylmethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074465
2-(Oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
CID 103074466
N-methyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine
CID 103074467

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine?
The IUPAC name of N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine (CID 103074461) is N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine.
What is the SMILES notation for N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine?
The canonical SMILES for N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine is C=C(CNCC)COCC1CCCO1.
What is the InChIKey of N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine?
The InChIKey is WVUAFXLWELKCIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-12-7-10(2)8-13-9-11-5-4-6-14-11/h11-12H,2-9H2,1H3.
What are the key properties of N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine?
N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine has a molecular weight of 199.29 g/mol, XLogP of 1.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(oxolan-2-ylmethoxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 103074461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).