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

C15H23N3 — CID 62274891

IUPAC3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
SMILESCC(c1cccnc1)N1CCCC1C1CCCN1
InChIInChI=1S/C15H23N3/c1-12(13-5-2-8-16-11-13)18-10-4-7-15(18)14-6-3-9-17-14/h2,5,8,11-12,14-15,17H,3-4,6-7,9-10H2,1H3
InChIKeyKGJMTSHSPWCZBD-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.36
Rot. Bonds3

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

3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine (PubChem CID 62274891) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine.

Molecular Properties

Compound Name3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
PubChem CID62274891
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
SMILESCC(c1cccnc1)N1CCCC1C1CCCN1
InChIInChI=1S/C15H23N3/c1-12(13-5-2-8-16-11-13)18-10-4-7-15(18)14-6-3-9-17-14/h2,5,8,11-12,14-15,17H,3-4,6-7,9-10H2,1H3
InChIKeyKGJMTSHSPWCZBD-UHFFFAOYSA-N
XLogP2.36
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 62273687
(4aS,8aS)-4-[(1R)-1-phenylethyl]-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline
CID 124857914
1-propan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 63256346
1-[1-(2-chlorophenyl)ethyl]-2-pyrrolidin-2-ylpiperidine
CID 63256309
5-fluoro-2-[1-(2-pyrrolidin-2-ylpiperidin-1-yl)ethyl]pyridine
CID 83124822
[4-(1-pyridin-3-ylethyl)piperazin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 122081611
3-[(2R)-1-[(1S)-1-phenylethyl]pyrrolidin-2-yl]pyridine
CID 101170650
3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
CID 63262845
1-[1-(2,5-dichlorophenyl)ethyl]-2-pyrrolidin-2-ylpyrrolidine
CID 62274734
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-1-pyridin-3-ylpropan-2-amine
CID 65319111
3-[(1R)-1-[(2S)-2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]ethyl]pyridine
CID 129461551

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The IUPAC name of 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine (CID 62274891) is 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine.
What is the SMILES notation for 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The canonical SMILES for 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine is CC(c1cccnc1)N1CCCC1C1CCCN1.
What is the InChIKey of 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
The InChIKey is KGJMTSHSPWCZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-12(13-5-2-8-16-11-13)18-10-4-7-15(18)14-6-3-9-17-14/h2,5,8,11-12,14-15,17H,3-4,6-7,9-10H2,1H3.
What are the key properties of 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine?
3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine has a molecular weight of 245.37 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine is sourced from PubChem (CID 62274891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).