3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine

C11H21NO2 — CID 104871908

IUPAC3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
SMILESC=C(C)COCCNC1CC(OC)C1
InChIInChI=1S/C11H21NO2/c1-9(2)8-14-5-4-12-10-6-11(7-10)13-3/h10-12H,1,4-8H2,2-3H3
InChIKeyUBKTTZUCCXDBMY-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.35
Rot. Bonds7

About 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine

3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine (PubChem CID 104871908) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
PubChem CID104871908
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
SMILESC=C(C)COCCNC1CC(OC)C1
InChIInChI=1S/C11H21NO2/c1-9(2)8-14-5-4-12-10-6-11(7-10)13-3/h10-12H,1,4-8H2,2-3H3
InChIKeyUBKTTZUCCXDBMY-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-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

2-(2-methylprop-2-enoxy)-N-prop-2-ynylcyclobutan-1-amine
CID 121451211
N-methyl-2-(2-methylprop-2-enoxy)cyclobutan-1-amine
CID 121451213
3-methoxy-3-methyl-N-[2-(2-methylprop-2-enoxy)ethyl]butan-1-amine
CID 103033655
2-(cyclobutyloxymethyl)-N-ethylprop-2-en-1-amine
CID 103074723
2-(cyclobutyloxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074725
N-tert-butyl-2-(cyclobutyloxymethyl)prop-2-en-1-amine
CID 103074726
2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine
CID 103074727
N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutanamine
CID 104005635
3-methyl-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
CID 104859927
1-(aminomethyl)-3-ethoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
CID 106822338
1-(aminomethyl)-3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
CID 106822339
3-ethoxy-2,2-dimethyl-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine
CID 113352236

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine?
The IUPAC name of 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine (CID 104871908) is 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine?
The canonical SMILES for 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine is C=C(C)COCCNC1CC(OC)C1.
What is the InChIKey of 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine?
The InChIKey is UBKTTZUCCXDBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(2)8-14-5-4-12-10-6-11(7-10)13-3/h10-12H,1,4-8H2,2-3H3.
What are the key properties of 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine?
3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-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 3-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]cyclobutan-1-amine is sourced from PubChem (CID 104871908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).