2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine

C19H31NO — CID 66358462

IUPAC2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(Oc2ccccc2CC)C1(CC)CC
InChIInChI=1S/C19H31NO/c1-5-13-20-17-14-18(19(17,7-3)8-4)21-16-12-10-9-11-15(16)6-2/h9-12,17-18,20H,5-8,13-14H2,1-4H3
InChIKeyYJKNIBJMBAVPGM-UHFFFAOYSA-N
MW289.46 g/mol
LogP4.57
Rot. Bonds8

About 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine

2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine (PubChem CID 66358462) has the molecular formula C19H31NO and a molecular weight of 289.46 g/mol. Its IUPAC name is 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine
PubChem CID66358462
Molecular FormulaC19H31NO
Molecular Weight289.46 g/mol
Exact Mass289.24
IUPAC Name2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine
SMILESCCCNC1CC(Oc2ccccc2CC)C1(CC)CC
InChIInChI=1S/C19H31NO/c1-5-13-20-17-14-18(19(17,7-3)8-4)21-16-12-10-9-11-15(16)6-2/h9-12,17-18,20H,5-8,13-14H2,1-4H3
InChIKeyYJKNIBJMBAVPGM-UHFFFAOYSA-N
XLogP4.57
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.46
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-diethyl-3-(2-ethylphenoxy)-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

1-(3-bromo-2,2-diethylcyclobutyl)oxy-2-ethylbenzene
CID 66344287
3-(2,6-dichlorophenoxy)-2,2-diethyl-N-propylcyclobutan-1-amine
CID 66357264
2,2-diethyl-3-(3-iodophenoxy)-N-propylcyclobutan-1-amine
CID 66357441
2,2-diethyl-3-(3-methylbutoxy)-N-propylcyclobutan-1-amine
CID 66359399
2-ethyl-3-(2-ethylphenoxy)-2-methylcyclobutan-1-one
CID 66368471
3-[(4-bromophenyl)methoxy]-2,2-diethyl-N-propylcyclobutan-1-amine
CID 82808639
3-butoxy-2,2-diethyl-N-propylcyclobutan-1-amine
CID 66356852
N,2,2-triethyl-3-(4-fluorophenoxy)cyclobutan-1-amine
CID 66358535
3-(2,5-difluorophenoxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66351359
2,2-diethyl-3-(2-methoxyethoxy)-N-propylcyclobutan-1-amine
CID 66357579
3-(2,3-dichlorophenoxy)-2,2-diethyl-N-methylcyclobutan-1-amine
CID 66356998
2,2-dimethyl-3-(3-methyl-2-nitrophenoxy)-N-propylcyclobutan-1-amine
CID 66358081

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine?
The IUPAC name of 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine (CID 66358462) is 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine.
What is the SMILES notation for 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine?
The canonical SMILES for 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine is CCCNC1CC(Oc2ccccc2CC)C1(CC)CC.
What is the InChIKey of 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine?
The InChIKey is YJKNIBJMBAVPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO/c1-5-13-20-17-14-18(19(17,7-3)8-4)21-16-12-10-9-11-15(16)6-2/h9-12,17-18,20H,5-8,13-14H2,1-4H3.
What are the key properties of 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine?
2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine has a molecular weight of 289.46 g/mol, XLogP of 4.57, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-3-(2-ethylphenoxy)-N-propylcyclobutan-1-amine is sourced from PubChem (CID 66358462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).