1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine

C12H25NO2 — CID 121012447

IUPAC1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine
SMILESCCOCCN1CCCCC1COCC
InChIInChI=1S/C12H25NO2/c1-3-14-10-9-13-8-6-5-7-12(13)11-15-4-2/h12H,3-11H2,1-2H3
InChIKeySHOYAXBFPHPDAG-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.91
Rot. Bonds7

About 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine

1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine (PubChem CID 121012447) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine
PubChem CID121012447
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine
SMILESCCOCCN1CCCCC1COCC
InChIInChI=1S/C12H25NO2/c1-3-14-10-9-13-8-6-5-7-12(13)11-15-4-2/h12H,3-11H2,1-2H3
InChIKeySHOYAXBFPHPDAG-UHFFFAOYSA-N
XLogP1.91
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(bromomethyl)-1-(2-ethoxyethyl)piperidine
CID 80674315
3-[(2R)-2-(ethoxymethyl)piperidin-1-yl]propan-1-amine
CID 129323114
3-[(2R)-2-(ethoxymethyl)piperidin-1-yl]propanoic acid
CID 129323089
N-[[1-(2-ethoxyethyl)piperidin-2-yl]methyl]propan-2-amine
CID 62581842
2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol
CID 129495167
[(2S)-1-(2-ethoxyethyl)pyrrolidin-2-yl]methanol
CID 112734321
N-[[1-(2-ethoxyethyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 62581621
1-(2-ethoxyethyl)-2-methylpyrrolidine
CID 175912703
1-[2-(2-chloroethoxy)ethyl]-2-propylpiperidine
CID 83061887
(1S)-1-[(2R)-1-(2-ethoxyethyl)piperidin-2-yl]propan-1-ol
CID 95634837
ethane;2-(ethoxymethyl)-1-methylpyrrolidine
CID 169145954
N-[[1-(2-ethoxyethyl)pyrrolidin-2-yl]methyl]-N',N'-dimethylethane-1,2-diamine
CID 58858738

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine?
The IUPAC name of 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine (CID 121012447) is 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine.
What is the SMILES notation for 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine?
The canonical SMILES for 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine is CCOCCN1CCCCC1COCC.
What is the InChIKey of 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine?
The InChIKey is SHOYAXBFPHPDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-14-10-9-13-8-6-5-7-12(13)11-15-4-2/h12H,3-11H2,1-2H3.
What are the key properties of 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine?
1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine has a molecular weight of 215.34 g/mol, XLogP of 1.91, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine is sourced from PubChem (CID 121012447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).