3-(1-ethylpyrrolidin-2-yl)pyridine

C11H16N2 — CID 4658388

IUPAC3-(1-ethylpyrrolidin-2-yl)pyridine
SMILESCCN1CCCC1c1cccnc1
InChIInChI=1S/C11H16N2/c1-2-13-8-4-6-11(13)10-5-3-7-12-9-10/h3,5,7,9,11H,2,4,6,8H2,1H3
InChIKeyVXSLBTSUIZUVFX-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.24
Rot. Bonds2

About 3-(1-ethylpyrrolidin-2-yl)pyridine

3-(1-ethylpyrrolidin-2-yl)pyridine (PubChem CID 4658388) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 3-(1-ethylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name3-(1-ethylpyrrolidin-2-yl)pyridine
PubChem CID4658388
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name3-(1-ethylpyrrolidin-2-yl)pyridine
SMILESCCN1CCCC1c1cccnc1
InChIInChI=1S/C11H16N2/c1-2-13-8-4-6-11(13)10-5-3-7-12-9-10/h3,5,7,9,11H,2,4,6,8H2,1H3
InChIKeyVXSLBTSUIZUVFX-UHFFFAOYSA-N
XLogP2.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpyrrolidin-2-yl)pyridine?
The IUPAC name of 3-(1-ethylpyrrolidin-2-yl)pyridine (CID 4658388) is 3-(1-ethylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 3-(1-ethylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 3-(1-ethylpyrrolidin-2-yl)pyridine is CCN1CCCC1c1cccnc1.
What is the InChIKey of 3-(1-ethylpyrrolidin-2-yl)pyridine?
The InChIKey is VXSLBTSUIZUVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-2-13-8-4-6-11(13)10-5-3-7-12-9-10/h3,5,7,9,11H,2,4,6,8H2,1H3.
What are the key properties of 3-(1-ethylpyrrolidin-2-yl)pyridine?
3-(1-ethylpyrrolidin-2-yl)pyridine has a molecular weight of 176.26 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 4658388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).