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

C14H22N2O2 — CID 114796587

IUPAC3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESCCCOc1cccnc1OCCC1CCNC1
InChIInChI=1S/C14H22N2O2/c1-2-9-17-13-4-3-7-16-14(13)18-10-6-12-5-8-15-11-12/h3-4,7,12,15H,2,5-6,8-11H2,1H3
InChIKeyRJOAJWUOLBDAOG-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.25
Rot. Bonds7

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

3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine (PubChem CID 114796587) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine.

Molecular Properties

Compound Name3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
PubChem CID114796587
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
SMILESCCCOc1cccnc1OCCC1CCNC1
InChIInChI=1S/C14H22N2O2/c1-2-9-17-13-4-3-7-16-14(13)18-10-6-12-5-8-15-11-12/h3-4,7,12,15H,2,5-6,8-11H2,1H3
InChIKeyRJOAJWUOLBDAOG-UHFFFAOYSA-N
XLogP2.25
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796289
3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796420
3-bromo-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796523
3-[(2-propoxyphenoxy)methyl]pyrrolidine
CID 55064564
3-[phenyl-[(3S)-pyrrolidin-3-yl]methoxy]-2-propoxypyridine
CID 66753085
3-[2-(2-fluorophenoxy)ethyl]pyrrolidine;hydrochloride
CID 146064557
2-(2-piperidin-4-ylethoxy)pyridin-3-ol;hydrochloride
CID 71646434
4-(2-pyrrolidin-3-ylethoxy)pyrazolo[1,5-a]pyrazine
CID 114796406
(3R)-3-[2-(2-ethoxyphenoxy)ethyl]piperidine
CID 86321016
1-ethyl-3-(2-pyrrolidin-3-ylethoxy)pyrazin-2-one
CID 114796570
4-[2-(2-ethoxyphenoxy)ethyl]piperidine;hydrochloride
CID 56830114
2,3-didecoxypyridine
CID 151922374

Frequently Asked Questions

What is the IUPAC name of 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The IUPAC name of 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine (CID 114796587) is 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine.
What is the SMILES notation for 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The canonical SMILES for 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine is CCCOc1cccnc1OCCC1CCNC1.
What is the InChIKey of 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
The InChIKey is RJOAJWUOLBDAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-2-9-17-13-4-3-7-16-14(13)18-10-6-12-5-8-15-11-12/h3-4,7,12,15H,2,5-6,8-11H2,1H3.
What are the key properties of 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine?
3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine has a molecular weight of 250.34 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine is sourced from PubChem (CID 114796587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).