3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine

C11H15ClN2O — CID 114796420

IUPAC3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESClc1cccnc1OCCC1CCNC1
InChIInChI=1S/C11H15ClN2O/c12-10-2-1-5-14-11(10)15-7-4-9-3-6-13-8-9/h1-2,5,9,13H,3-4,6-8H2
InChIKeyIGROCHDMFAPOJW-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.11
Rot. Bonds4

About 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine

3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine (PubChem CID 114796420) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine.

Molecular Properties

Compound Name3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
PubChem CID114796420
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESClc1cccnc1OCCC1CCNC1
InChIInChI=1S/C11H15ClN2O/c12-10-2-1-5-14-11(10)15-7-4-9-3-6-13-8-9/h1-2,5,9,13H,3-4,6-8H2
InChIKeyIGROCHDMFAPOJW-UHFFFAOYSA-N
XLogP2.11
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Chloro-5-((R)-1-pyrrolidin-2-ylmethoxy)-pyridine
CID 10512747
2-Chloro-5-((S)-1-pyrrolidin-2-ylmethoxy)-pyridine
CID 10589238
(1S,3S,5S)-3-[(2-chloro-3-pyridinyl)oxymethyl]-2-azabicyclo[3.1.0]hexane;hydrochloride
CID 156020751
(1S,2S,5R)-2-[(6-chloro-3-pyridinyl)oxymethyl]-3-azabicyclo[3.1.0]hexane
CID 156021005
2-(Piperidin-4-ylmethoxy)-pyridine hydrochloride
CID 24746775
(1S,5R)-1-[(6-chloro-3-pyridinyl)oxymethyl]-2-azabicyclo[3.1.0]hexane;hydrochloride
CID 156015026
(1R,3S,5R)-3-[(2-chloro-3-pyridinyl)oxymethyl]-2-azabicyclo[3.1.0]hexane;hydrochloride
CID 156018134
2-(Piperidin-4-ylmethoxy)pyridine
CID 6498685
Ethanethiol, 2-(3-(3-chloro-2-pyridyloxy)propyl)amino-, hydrogen sulfate (ester)
CID 218738
5-Chloro-2-(piperidin-3-yloxy)pyridine
CID 62348173
3-Chloro-2-ethoxypyridine
CID 11959087
3-Chloro-2-methoxypyridine
CID 13295749

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The IUPAC name of 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine (CID 114796420) is 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine.
What is the SMILES notation for 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The canonical SMILES for 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine is Clc1cccnc1OCCC1CCNC1.
What is the InChIKey of 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The InChIKey is IGROCHDMFAPOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c12-10-2-1-5-14-11(10)15-7-4-9-3-6-13-8-9/h1-2,5,9,13H,3-4,6-8H2.
What are the key properties of 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine?
3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine has a molecular weight of 226.71 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine is sourced from PubChem (CID 114796420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).