2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine

C18H29NO2 — CID 103168605

IUPAC2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
SMILESCCNC(CC1CC(OCC)C1)c1ccccc1OCC
InChIInChI=1S/C18H29NO2/c1-4-19-17(13-14-11-15(12-14)20-5-2)16-9-7-8-10-18(16)21-6-3/h7-10,14-15,17,19H,4-6,11-13H2,1-3H3
InChIKeyGUXRDLRVPZTRDX-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.94
Rot. Bonds9

About 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine

2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine (PubChem CID 103168605) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
PubChem CID103168605
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
SMILESCCNC(CC1CC(OCC)C1)c1ccccc1OCC
InChIInChI=1S/C18H29NO2/c1-4-19-17(13-14-11-15(12-14)20-5-2)16-9-7-8-10-18(16)21-6-3/h7-10,14-15,17,19H,4-6,11-13H2,1-3H3
InChIKeyGUXRDLRVPZTRDX-UHFFFAOYSA-N
XLogP3.94
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-ethoxycyclobutyl)-1-(2-methylphenyl)ethyl]propan-1-amine
CID 103168245
1-(1-benzothiophen-3-yl)-2-(3-ethoxycyclobutyl)-N-ethylethanamine
CID 103162918
2-cyclobutyloxy-1-(2-ethoxyphenyl)-N-ethylethanamine
CID 62114747
2-cyclopropyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 64904236
1-(4-bromophenyl)-2-(3-ethoxycyclobutyl)-N-ethylethanamine
CID 103162875
2-(3-ethoxycyclobutyl)-1-(2-methoxyphenyl)ethanol
CID 103169884
2-cycloheptyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 115793056
2-(3-ethoxycyclobutyl)-N-ethyl-1-(4-propylphenyl)ethanamine
CID 103162908
2-(3-ethoxycyclobutyl)-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 103162901
1-(2-ethoxyphenyl)-N-ethyl-2-propan-2-ylsulfanylethanamine
CID 64632455
1-(3-bromo-4-methoxyphenyl)-2-(3-ethoxycyclobutyl)-N-ethylethanamine
CID 103162864
N-ethyl-2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethanamine
CID 104659878

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The IUPAC name of 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine (CID 103168605) is 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine is CCNC(CC1CC(OCC)C1)c1ccccc1OCC.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The InChIKey is GUXRDLRVPZTRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-4-19-17(13-14-11-15(12-14)20-5-2)16-9-7-8-10-18(16)21-6-3/h7-10,14-15,17,19H,4-6,11-13H2,1-3H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine has a molecular weight of 291.44 g/mol, XLogP of 3.94, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-1-(2-ethoxyphenyl)-N-ethylethanamine is sourced from PubChem (CID 103168605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).