4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine

C13H26N2O — CID 63904346

IUPAC4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine
SMILESCCC1CCCN1CCOC1CCNCC1
InChIInChI=1S/C13H26N2O/c1-2-12-4-3-9-15(12)10-11-16-13-5-7-14-8-6-13/h12-14H,2-11H2,1H3
InChIKeyNTGCIOUWMPPBPE-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds5

About 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine

4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine (PubChem CID 63904346) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine.

Molecular Properties

Compound Name4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine
PubChem CID63904346
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine
SMILESCCC1CCCN1CCOC1CCNCC1
InChIInChI=1S/C13H26N2O/c1-2-12-4-3-9-15(12)10-11-16-13-5-7-14-8-6-13/h12-14H,2-11H2,1H3
InChIKeyNTGCIOUWMPPBPE-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-1-(2-piperidin-4-yloxyethyl)azepane
CID 104690309
1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 55251141
4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride
CID 120663507
[1-(2-cycloheptyloxyethyl)piperidin-2-yl]methanol
CID 111448204
2-ethyl-1-propylpyrrolidine;hydrochloride
CID 175875106
2-ethyl-1-undecylpyrrolidine
CID 171569857
4-[3-(2-cyclopentylpyrrolidin-1-yl)propoxy]piperidine
CID 63903227
1-(2-bromoethyl)-2-ethylpyrrolidine
CID 61288740
4,4-dimethyl-1-(2-piperidin-4-yloxyethyl)piperidine
CID 63903619
1-(2-piperidin-4-yloxyethyl)-4-propylpiperidine
CID 63902666
3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine
CID 63904524
1-(2-cyclopentyloxyethyl)-2,5-diethylpiperazine
CID 64941027

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine?
The IUPAC name of 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine (CID 63904346) is 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine.
What is the SMILES notation for 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine?
The canonical SMILES for 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine is CCC1CCCN1CCOC1CCNCC1.
What is the InChIKey of 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine?
The InChIKey is NTGCIOUWMPPBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-12-4-3-9-15(12)10-11-16-13-5-7-14-8-6-13/h12-14H,2-11H2,1H3.
What are the key properties of 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine?
4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine is sourced from PubChem (CID 63904346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).