2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine

C12H25NO2 — CID 103273067

IUPAC2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine
SMILESCCNCCC1(OCCOCC)CCC1
InChIInChI=1S/C12H25NO2/c1-3-13-9-8-12(6-5-7-12)15-11-10-14-4-2/h13H,3-11H2,1-2H3
InChIKeyCKAUKNJXUQDJLZ-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.96
Rot. Bonds9

About 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine

2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine (PubChem CID 103273067) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine.

Molecular Properties

Compound Name2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine
PubChem CID103273067
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine
SMILESCCNCCC1(OCCOCC)CCC1
InChIInChI=1S/C12H25NO2/c1-3-13-9-8-12(6-5-7-12)15-11-10-14-4-2/h13H,3-11H2,1-2H3
InChIKeyCKAUKNJXUQDJLZ-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethyl]propan-1-amine
CID 103273032
N-ethyl-2-[1-(2,2,2-trifluoroethoxy)cyclobutyl]ethanamine
CID 103273033
N-[2-[1-(2,2-difluoroethoxy)cyclobutyl]ethyl]propan-1-amine
CID 103274349
2-[1-(2,2-difluoroethoxy)cyclobutyl]-N-ethylethanamine
CID 103274350
N-[2-[1-(3,3,3-trifluoropropoxy)cyclobutyl]ethyl]propan-1-amine
CID 103274392
N-ethyl-2-[1-(3,3,3-trifluoropropoxy)cyclobutyl]ethanamine
CID 103274393
N-[2-[1-(4,4,4-trifluorobutoxy)cyclobutyl]ethyl]propan-1-amine
CID 113797093
N-ethyl-2-[1-(4,4,4-trifluorobutoxy)cyclobutyl]ethanamine
CID 113797094
3-methyl-3-propoxy-N-propylpentan-1-amine
CID 89311705
5-Oxa-9-azaspiro[3.7]undecane
CID 118209933
4-[2-[(2R)-2-butoxypropoxy]ethoxy]-4-methylpiperidine
CID 126591976
3-butoxy-N,3-dimethylpentan-1-amine
CID 130337112

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine?
The IUPAC name of 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine (CID 103273067) is 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine.
What is the SMILES notation for 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine?
The canonical SMILES for 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine is CCNCCC1(OCCOCC)CCC1.
What is the InChIKey of 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine?
The InChIKey is CKAUKNJXUQDJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-13-9-8-12(6-5-7-12)15-11-10-14-4-2/h13H,3-11H2,1-2H3.
What are the key properties of 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine?
2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine has a molecular weight of 215.34 g/mol, XLogP of 1.96, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethoxyethoxy)cyclobutyl]-N-ethylethanamine is sourced from PubChem (CID 103273067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).