N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine

C15H23NO2 — CID 66358543

IUPACN-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine
SMILESCCNC1CC(Oc2ccccc2OC)C1(C)C
InChIInChI=1S/C15H23NO2/c1-5-16-13-10-14(15(13,2)3)18-12-9-7-6-8-11(12)17-4/h6-9,13-14,16H,5,10H2,1-4H3
InChIKeyPNWKYFRTACOUOD-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.85
Rot. Bonds5

About N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine

N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine (PubChem CID 66358543) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine
PubChem CID66358543
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine
SMILESCCNC1CC(Oc2ccccc2OC)C1(C)C
InChIInChI=1S/C15H23NO2/c1-5-16-13-10-14(15(13,2)3)18-12-9-7-6-8-11(12)17-4/h6-9,13-14,16H,5,10H2,1-4H3
InChIKeyPNWKYFRTACOUOD-UHFFFAOYSA-N
XLogP2.85
TPSA30.49 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 ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,2-dimethyl-3-(2-propan-2-ylphenoxy)cyclobutan-1-amine
CID 66359159
3-(1-bromonaphthalen-2-yl)oxy-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 66352422
N-ethyl-3-(2-methoxy-5-nitrophenoxy)-2,2-dimethylcyclobutan-1-amine
CID 66358965
3-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 66357294
3-(2,6-dichlorophenoxy)-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 66357271
3-(2-chloro-4-methylphenoxy)-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 66351139
N-ethyl-2,2-dimethyl-3-phenylmethoxycyclobutan-1-amine
CID 66358982
3-(5-bromo-2-fluorophenoxy)-N-ethyl-2,2-dimethylcyclobutan-1-amine
CID 114677211
N,2,2-triethyl-3-(2-iodophenoxy)cyclobutan-1-amine
CID 66358483
2,2-dimethyl-N-propyl-3-quinolin-5-yloxycyclobutan-1-amine
CID 103046085
3-(2,5-difluorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66351359
N-ethyl-3-(2-fluorophenoxy)spiro[3.6]decan-1-amine
CID 66357502

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine?
The IUPAC name of N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine (CID 66358543) is N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine?
The canonical SMILES for N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine is CCNC1CC(Oc2ccccc2OC)C1(C)C.
What is the InChIKey of N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine?
The InChIKey is PNWKYFRTACOUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-16-13-10-14(15(13,2)3)18-12-9-7-6-8-11(12)17-4/h6-9,13-14,16H,5,10H2,1-4H3.
What are the key properties of N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine?
N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine has a molecular weight of 249.35 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methoxyphenoxy)-2,2-dimethylcyclobutan-1-amine is sourced from PubChem (CID 66358543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).