3-pyrrolidin-2-ylpyridine

C9H12N2 — CID 412

IUPAC3-pyrrolidin-2-ylpyridine
SMILESc1cncc(C2CCCN2)c1
InChIInChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2
InChIKeyMYKUKUCHPMASKF-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.51
Rot. Bonds1

About 3-pyrrolidin-2-ylpyridine

3-pyrrolidin-2-ylpyridine (PubChem CID 412) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3-pyrrolidin-2-ylpyridine.

Molecular Properties

Compound Name3-pyrrolidin-2-ylpyridine
PubChem CID412
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3-pyrrolidin-2-ylpyridine
SMILESc1cncc(C2CCCN2)c1
InChIInChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2
InChIKeyMYKUKUCHPMASKF-UHFFFAOYSA-N
XLogP1.51
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Nicotine
CID 89594
Anabasine
CID 205586
Nornicotine
CID 91462
Epibatidine
CID 854023
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
Prothionamide
CID 666418
(+-)-Anabasine
CID 2181
Myosmine
CID 442649
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
N-Nitrosonornicotine
CID 12613538
5-Ethyl-2-methylpyridine
CID 7728

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-2-ylpyridine?
The IUPAC name of 3-pyrrolidin-2-ylpyridine (CID 412) is 3-pyrrolidin-2-ylpyridine.
What is the SMILES notation for 3-pyrrolidin-2-ylpyridine?
The canonical SMILES for 3-pyrrolidin-2-ylpyridine is c1cncc(C2CCCN2)c1.
What is the InChIKey of 3-pyrrolidin-2-ylpyridine?
The InChIKey is MYKUKUCHPMASKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2.
What are the key properties of 3-pyrrolidin-2-ylpyridine?
3-pyrrolidin-2-ylpyridine has a molecular weight of 148.21 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-2-ylpyridine is sourced from PubChem (CID 412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).