2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine

C11H22N2 — CID 114794707

IUPAC2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine
SMILESCCC1CN(CCC2CCCN2)C1
InChIInChI=1S/C11H22N2/c1-2-10-8-13(9-10)7-5-11-4-3-6-12-11/h10-12H,2-9H2,1H3
InChIKeyAYFSQTAYJGSDCK-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.47
Rot. Bonds4

About 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine

2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine (PubChem CID 114794707) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine.

Molecular Properties

Compound Name2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine
PubChem CID114794707
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine
SMILESCCC1CN(CCC2CCCN2)C1
InChIInChI=1S/C11H22N2/c1-2-10-8-13(9-10)7-5-11-4-3-6-12-11/h10-12H,2-9H2,1H3
InChIKeyAYFSQTAYJGSDCK-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-(2-piperidin-2-ylethyl)piperidine
CID 43584590
2,6-dimethyl-4-(2-pyrrolidin-2-ylethyl)morpholine
CID 61366072
1-ethyl-4-(2-piperidin-2-ylethyl)piperazine
CID 43149889
1,2-dimethyl-4-(2-pyrrolidin-2-ylethyl)piperazine
CID 63621062
N,N-dimethyl-1-(2-pyrrolidin-2-ylethyl)piperidin-4-amine
CID 61364502
4-ethyl-1-(3-piperidin-2-ylpropyl)piperidine
CID 62212363
ethane;2-propylpyrrolidine
CID 143349498
ethane;(2R)-2-propylpyrrolidine
CID 155717204
2-(2-ethylsulfonylethyl)pyrrolidine
CID 84663605
2-(2-cyclopropylethyl)pyrrolidine
CID 23166213
3-ethyl-1-[2-(4-methylcyclohexyl)ethyl]-1,4-diazepane
CID 64949634
(2R)-2-ethyl-1-[2-[(2S)-piperidin-2-yl]ethyl]piperidine
CID 28704997

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine?
The IUPAC name of 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine (CID 114794707) is 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine.
What is the SMILES notation for 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine?
The canonical SMILES for 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine is CCC1CN(CCC2CCCN2)C1.
What is the InChIKey of 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine?
The InChIKey is AYFSQTAYJGSDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-10-8-13(9-10)7-5-11-4-3-6-12-11/h10-12H,2-9H2,1H3.
What are the key properties of 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine?
2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine has a molecular weight of 182.31 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-ethylazetidin-1-yl)ethyl]pyrrolidine is sourced from PubChem (CID 114794707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).