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

C13H20N2O2 — CID 114796289

IUPAC3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESCCOc1cccnc1OCCC1CCNC1
InChIInChI=1S/C13H20N2O2/c1-2-16-12-4-3-7-15-13(12)17-9-6-11-5-8-14-10-11/h3-4,7,11,14H,2,5-6,8-10H2,1H3
InChIKeyDZQJBANFNJZXGY-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.86
Rot. Bonds6

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

3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine (PubChem CID 114796289) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine.

Molecular Properties

Compound Name3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
PubChem CID114796289
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESCCOc1cccnc1OCCC1CCNC1
InChIInChI=1S/C13H20N2O2/c1-2-16-12-4-3-7-15-13(12)17-9-6-11-5-8-14-10-11/h3-4,7,11,14H,2,5-6,8-10H2,1H3
InChIKeyDZQJBANFNJZXGY-UHFFFAOYSA-N
XLogP1.86
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796587
3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796420
3-bromo-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796523
(3R)-3-[2-(2-ethoxyphenoxy)ethyl]piperidine
CID 86321016
4-[2-(2-ethoxyphenoxy)ethyl]piperidine;hydrochloride
CID 56830114
2-(2-piperidin-4-ylethoxy)pyridin-3-ol;hydrochloride
CID 71646434
4-(2-pyrrolidin-3-ylethoxy)pyrazolo[1,5-a]pyrazine
CID 114796406
1-ethyl-3-(2-pyrrolidin-3-ylethoxy)pyrazin-2-one
CID 114796570
3-[2-(2-fluorophenoxy)ethyl]pyrrolidine;hydrochloride
CID 146064557
2-methyl-3-[2-[(3R)-piperidin-3-yl]ethoxy]pyrazine
CID 97163244
3-methoxy-2-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
CID 153376724
6-methoxy-1-(2-pyrrolidin-3-ylethoxy)isoquinoline
CID 106542215

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The IUPAC name of 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine (CID 114796289) is 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine.
What is the SMILES notation for 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The canonical SMILES for 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine is CCOc1cccnc1OCCC1CCNC1.
What is the InChIKey of 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The InChIKey is DZQJBANFNJZXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-16-12-4-3-7-15-13(12)17-9-6-11-5-8-14-10-11/h3-4,7,11,14H,2,5-6,8-10H2,1H3.
What are the key properties of 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine has a molecular weight of 236.31 g/mol, XLogP of 1.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine is sourced from PubChem (CID 114796289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).