3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine

C15H23N3 — CID 63262845

IUPAC3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
SMILESc1cncc(CCN2CCCC2C2CCCN2)c1
InChIInChI=1S/C15H23N3/c1-4-13(12-16-8-1)7-11-18-10-3-6-15(18)14-5-2-9-17-14/h1,4,8,12,14-15,17H,2-3,5-7,9-11H2
InChIKeyGORFVZUPGGUVOH-UHFFFAOYSA-N
MW245.37 g/mol
LogP1.84
Rot. Bonds4

About 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine

3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine (PubChem CID 63262845) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine.

Molecular Properties

Compound Name3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
PubChem CID63262845
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
SMILESc1cncc(CCN2CCCC2C2CCCN2)c1
InChIInChI=1S/C15H23N3/c1-4-13(12-16-8-1)7-11-18-10-3-6-15(18)14-5-2-9-17-14/h1,4,8,12,14-15,17H,2-3,5-7,9-11H2
InChIKeyGORFVZUPGGUVOH-UHFFFAOYSA-N
XLogP1.84
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-phenylethyl)-2-pyrrolidin-2-ylpyrrolidine
CID 62273352
3-methyl-1-(2-pyridin-3-ylethyl)piperidine-2-carboxylic acid
CID 107072568
3-pyridin-3-yl-1-(3-pyrrolidin-2-ylpiperidin-1-yl)propan-1-one
CID 114289950
[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine
CID 63262844
1-(2-fluoroethyl)-2-pyrrolidin-2-ylpyrrolidine
CID 80693813
3-[2-[(2S)-2-(5-methylfuran-2-yl)pyrrolidin-1-yl]ethyl]pyridine
CID 124742750
2-pyrrolidin-2-yl-1-(2-thiophen-2-ylethyl)piperidine
CID 63775718
3-[1-(2-phenylethyl)pyrrolidin-2-yl]pyridine
CID 91294184
3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
CID 62274891
3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
CID 112650958
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
2-pyridin-3-yl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106637852

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The IUPAC name of 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine (CID 63262845) is 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine.
What is the SMILES notation for 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The canonical SMILES for 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine is c1cncc(CCN2CCCC2C2CCCN2)c1.
What is the InChIKey of 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The InChIKey is GORFVZUPGGUVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-4-13(12-16-8-1)7-11-18-10-3-6-15(18)14-5-2-9-17-14/h1,4,8,12,14-15,17H,2-3,5-7,9-11H2.
What are the key properties of 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine has a molecular weight of 245.37 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine is sourced from PubChem (CID 63262845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).