2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine

C17H27NO3 — CID 104676533

IUPAC2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(Oc2cccc(COC)c2)C1OCC
InChIInChI=1S/C17H27NO3/c1-4-9-18-15-11-16(17(15)20-5-2)21-14-8-6-7-13(10-14)12-19-3/h6-8,10,15-18H,4-5,9,11-12H2,1-3H3
InChIKeySMFWYWMIPLQWJG-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.76
Rot. Bonds9

About 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine

2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine (PubChem CID 104676533) has the molecular formula C17H27NO3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine.

Molecular Properties

Compound Name2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine
PubChem CID104676533
Molecular FormulaC17H27NO3
Molecular Weight293.41 g/mol
Exact Mass293.20
IUPAC Name2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(Oc2cccc(COC)c2)C1OCC
InChIInChI=1S/C17H27NO3/c1-4-9-18-15-11-16(17(15)20-5-2)21-14-8-6-7-13(10-14)12-19-3/h6-8,10,15-18H,4-5,9,11-12H2,1-3H3
InChIKeySMFWYWMIPLQWJG-UHFFFAOYSA-N
XLogP2.76
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-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

3-[3-(methoxymethyl)phenoxy]-N-propyloxan-4-amine
CID 63985564
3-(4-bromophenoxy)-2-ethoxy-N-propylcyclobutan-1-amine
CID 104675985
2-ethoxy-3-phenylmethoxy-N-propylcyclobutan-1-amine
CID 104676122
3-[(3-bromophenyl)methoxy]-2-propoxy-N-propylcyclobutan-1-amine
CID 107943815
2-ethoxy-3-(2-fluoro-3-methylphenoxy)-N-propylcyclobutan-1-amine
CID 107662341
1-(3-chloro-2-methoxycyclobutyl)oxy-3-(methoxymethyl)benzene
CID 104674108
3-(2-chlorophenoxy)-2-ethoxy-N-propylcyclobutan-1-amine
CID 104675988
3-ethoxy-2-methoxy-N-[2-(3-methoxyphenyl)ethyl]cyclobutan-1-amine
CID 107850234
2-ethoxy-N-ethyl-3-[3-(trifluoromethyl)phenoxy]cyclobutan-1-amine
CID 104676220
2-[(3-methoxyphenyl)methoxy]-N-propylcyclohexan-1-amine
CID 62111265
2-methoxy-3-(3-nitrophenoxy)-N-propylcyclobutan-1-amine
CID 104674385
3-(3-bromophenoxy)-2-ethoxy-N-methylcyclobutan-1-amine
CID 104676021

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine?
The IUPAC name of 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine (CID 104676533) is 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine.
What is the SMILES notation for 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine?
The canonical SMILES for 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine is CCCNC1CC(Oc2cccc(COC)c2)C1OCC.
What is the InChIKey of 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine?
The InChIKey is SMFWYWMIPLQWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO3/c1-4-9-18-15-11-16(17(15)20-5-2)21-14-8-6-7-13(10-14)12-19-3/h6-8,10,15-18H,4-5,9,11-12H2,1-3H3.
What are the key properties of 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine?
2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine has a molecular weight of 293.41 g/mol, XLogP of 2.76, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-[3-(methoxymethyl)phenoxy]-N-propylcyclobutan-1-amine is sourced from PubChem (CID 104676533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).