4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride

C13H27ClN2 — CID 120663507

IUPAC4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride
SMILESCCC1CCCN1CCC1CCNCC1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-2-13-4-3-10-15(13)11-7-12-5-8-14-9-6-12;/h12-14H,2-11H2,1H3;1H
InChIKeySMWOGDDNYPJEKL-UHFFFAOYSA-N
MW246.83 g/mol
LogP2.67
Rot. Bonds4

About 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride

4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride (PubChem CID 120663507) has the molecular formula C13H27ClN2 and a molecular weight of 246.83 g/mol. Its IUPAC name is 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride.

Molecular Properties

Compound Name4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride
PubChem CID120663507
Molecular FormulaC13H27ClN2
Molecular Weight246.83 g/mol
Exact Mass246.19
IUPAC Name4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride
SMILESCCC1CCCN1CCC1CCNCC1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-2-13-4-3-10-15(13)11-7-12-5-8-14-9-6-12;/h12-14H,2-11H2,1H3;1H
InChIKeySMWOGDDNYPJEKL-UHFFFAOYSA-N
XLogP2.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.83
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-(2-piperidin-3-ylethyl)piperidine;dihydrochloride
CID 56831677
4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine
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2-ethyl-1-propylpyrrolidine;hydrochloride
CID 175875106
1,2-diethylpyrrolidine;hydrochloride
CID 175060343
(2R)-2-ethyl-1-[2-[(2S)-piperidin-2-yl]ethyl]piperidine
CID 28704997
1-(2-ethylpyrrolidin-1-yl)-3-piperidin-4-ylpropan-1-one
CID 62210226
2-ethyl-1-(2-piperidin-4-yloxyethyl)azepane
CID 104690309
4-[2-(2-ethylpyrrolidin-1-yl)sulfonylethyl]piperidine
CID 54885840
1-(2-bromoethyl)-2-ethylpyrrolidine
CID 61288740
3-methyl-1-(2-piperidin-4-ylethyl)piperidine;dihydrochloride
CID 56831695
(3S)-3-[(2-ethylpyrrolidin-1-yl)methyl]piperidine
CID 130522112
1-(cyclopropylmethyl)-2-ethylpyrrolidine
CID 59900579

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride?
The IUPAC name of 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride (CID 120663507) is 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride.
What is the SMILES notation for 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride?
The canonical SMILES for 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride is CCC1CCCN1CCC1CCNCC1.Cl.
What is the InChIKey of 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride?
The InChIKey is SMWOGDDNYPJEKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2.ClH/c1-2-13-4-3-10-15(13)11-7-12-5-8-14-9-6-12;/h12-14H,2-11H2,1H3;1H.
What are the key properties of 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride?
4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride has a molecular weight of 246.83 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-ethylpyrrolidin-1-yl)ethyl]piperidine;hydrochloride is sourced from PubChem (CID 120663507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).