2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine

C14H27NO2 — CID 106201025

IUPAC2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine
SMILESCCNC(COCCC1CCC1)C1CCOC1
InChIInChI=1S/C14H27NO2/c1-2-15-14(13-7-9-16-10-13)11-17-8-6-12-4-3-5-12/h12-15H,2-11H2,1H3
InChIKeyPYKYFPMFZUEGDV-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.21
Rot. Bonds8

About 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine

2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine (PubChem CID 106201025) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine
PubChem CID106201025
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine
SMILESCCNC(COCCC1CCC1)C1CCOC1
InChIInChI=1S/C14H27NO2/c1-2-15-14(13-7-9-16-10-13)11-17-8-6-12-4-3-5-12/h12-15H,2-11H2,1H3
InChIKeyPYKYFPMFZUEGDV-UHFFFAOYSA-N
XLogP2.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.21
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-ethyl-1-(oxolan-3-yl)-2-propoxyethanamine
CID 63564947
N-ethyl-2-[2-(2-methylpropoxy)ethoxy]-1-(oxolan-3-yl)ethanamine
CID 106447324
N-ethyl-2-(oxan-2-ylmethoxy)-1-(oxolan-3-yl)ethanamine
CID 104748775
N-[2-hexoxy-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 113448609
N'-(cyclopentylmethyl)-N-ethyl-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 113448260
2-(cyclopentylmethylsulfanyl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 113449540
3-ethoxy-N-ethyl-1-(oxan-3-yl)propan-1-amine
CID 107137018
N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
CID 65331868
N'-cyclopentyl-N-ethyl-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104744659
N-ethyl-1-(oxolan-3-yl)pentan-1-amine
CID 65330630
N-(2-ethoxyethyl)-1-(oxolan-3-yl)propan-1-amine
CID 115709966
N-ethyl-1-(oxolan-3-yl)-2-(thian-4-yl)ethanamine
CID 105147710

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine (CID 106201025) is 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine is CCNC(COCCC1CCC1)C1CCOC1.
What is the InChIKey of 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine?
The InChIKey is PYKYFPMFZUEGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-15-14(13-7-9-16-10-13)11-17-8-6-12-4-3-5-12/h12-15H,2-11H2,1H3.
What are the key properties of 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine?
2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine has a molecular weight of 241.37 g/mol, XLogP of 2.21, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylethoxy)-N-ethyl-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 106201025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).