3-pyrrolidin-3-ylpyridine

C9H12N2 — CID 3613651

IUPAC3-pyrrolidin-3-ylpyridine
SMILESc1cncc(C2CCNC2)c1
InChIInChI=1S/C9H12N2/c1-2-8(6-10-4-1)9-3-5-11-7-9/h1-2,4,6,9,11H,3,5,7H2
InChIKeyJNZDYUPZUHCHFK-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.16
Rot. Bonds1

About 3-pyrrolidin-3-ylpyridine

3-pyrrolidin-3-ylpyridine (PubChem CID 3613651) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3-pyrrolidin-3-ylpyridine.

Molecular Properties

Compound Name3-pyrrolidin-3-ylpyridine
PubChem CID3613651
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3-pyrrolidin-3-ylpyridine
SMILESc1cncc(C2CCNC2)c1
InChIInChI=1S/C9H12N2/c1-2-8(6-10-4-1)9-3-5-11-7-9/h1-2,4,6,9,11H,3,5,7H2
InChIKeyJNZDYUPZUHCHFK-UHFFFAOYSA-N
XLogP1.16
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 ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-piperidin-4-ylpyridine;dihydrochloride
CID 21192973
4-pyridin-3-ylazepane
CID 83262248
9-pyridin-3-yl-4-azabicyclo[5.3.1]undecane
CID 57485548
5-pyrrolidin-3-ylpyrimidine
CID 66996535
2-pyridin-3-ylpiperazine
CID 3872289
ethane;3-phenylpyrrolidine
CID 91032726
CID 156632351
CID 156632351
3-[(2S)-aziridin-2-yl]pyridine
CID 55263397
3-[3-(4-chlorophenyl)piperidin-4-yl]pyridine
CID 79434183
3-[3-(4-methylphenyl)piperidin-4-yl]pyridine
CID 79441307
3-[3-(2-chlorophenyl)piperidin-4-yl]pyridine
CID 79454588
3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
CID 96736316

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-3-ylpyridine?
The IUPAC name of 3-pyrrolidin-3-ylpyridine (CID 3613651) is 3-pyrrolidin-3-ylpyridine.
What is the SMILES notation for 3-pyrrolidin-3-ylpyridine?
The canonical SMILES for 3-pyrrolidin-3-ylpyridine is c1cncc(C2CCNC2)c1.
What is the InChIKey of 3-pyrrolidin-3-ylpyridine?
The InChIKey is JNZDYUPZUHCHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-8(6-10-4-1)9-3-5-11-7-9/h1-2,4,6,9,11H,3,5,7H2.
What are the key properties of 3-pyrrolidin-3-ylpyridine?
3-pyrrolidin-3-ylpyridine has a molecular weight of 148.21 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-3-ylpyridine is sourced from PubChem (CID 3613651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).