3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine

C15H23NO2 — CID 66358501

IUPAC3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine
SMILESCCOc1ccc(OC2CC(N)C2(C)CC)cc1
InChIInChI=1S/C15H23NO2/c1-4-15(3)13(16)10-14(15)18-12-8-6-11(7-9-12)17-5-2/h6-9,13-14H,4-5,10,16H2,1-3H3
InChIKeyREFHBMZJTDVCEO-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.98
Rot. Bonds5

About 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine

3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine (PubChem CID 66358501) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine
PubChem CID66358501
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine
SMILESCCOc1ccc(OC2CC(N)C2(C)CC)cc1
InChIInChI=1S/C15H23NO2/c1-4-15(3)13(16)10-14(15)18-12-8-6-11(7-9-12)17-5-2/h6-9,13-14H,4-5,10,16H2,1-3H3
InChIKeyREFHBMZJTDVCEO-UHFFFAOYSA-N
XLogP2.98
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-2-methyl-3-(4-propoxyphenoxy)cyclobutan-1-amine
CID 66357616
2-ethyl-3-(4-iodophenoxy)-2-methylcyclobutan-1-amine
CID 66356835
3-(4-ethoxyphenoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine
CID 66358502
2-ethyl-2-methyl-3-[4-(2-methylbutan-2-yl)phenoxy]cyclobutan-1-amine
CID 66357108
3-[(5-chloro-3-pyridinyl)oxy]-2-ethyl-2-methylcyclobutan-1-amine
CID 66352041
3-[3-bromo-4-(trifluoromethoxy)phenoxy]-2-ethyl-2-methylcyclobutan-1-amine
CID 102715077
3-(2,4-dichlorophenoxy)-2-ethyl-2-methylcyclobutan-1-amine
CID 66357326
2-ethyl-3-[4-(2-methoxyethoxy)phenyl]-2-methylcyclobutan-1-amine
CID 81416133
N,2-diethyl-3-(4-methoxyphenoxy)-2-methylcyclobutan-1-amine
CID 66358548
6-(4-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79836385
1-(3-bromo-2-ethyl-2-methylcyclobutyl)oxy-4-nitrobenzene
CID 66343582
2-ethyl-3-(4-methoxyphenoxy)-2-methyl-N-propylcyclobutan-1-amine
CID 66358954

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine?
The IUPAC name of 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine (CID 66358501) is 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine.
What is the SMILES notation for 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine?
The canonical SMILES for 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine is CCOc1ccc(OC2CC(N)C2(C)CC)cc1.
What is the InChIKey of 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine?
The InChIKey is REFHBMZJTDVCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-4-15(3)13(16)10-14(15)18-12-8-6-11(7-9-12)17-5-2/h6-9,13-14H,4-5,10,16H2,1-3H3.
What are the key properties of 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine?
3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine has a molecular weight of 249.35 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenoxy)-2-ethyl-2-methylcyclobutan-1-amine is sourced from PubChem (CID 66358501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).