3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine

C12H18N2 — CID 83907317

IUPAC3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
SMILESCC(CC1CCNC1)c1cccnc1
InChIInChI=1S/C12H18N2/c1-10(7-11-4-6-14-8-11)12-3-2-5-13-9-12/h2-3,5,9-11,14H,4,6-8H2,1H3
InChIKeyIHUUAAGLUPNLMY-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.18
Rot. Bonds3

About 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine

3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine (PubChem CID 83907317) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine.

Molecular Properties

Compound Name3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
PubChem CID83907317
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
SMILESCC(CC1CCNC1)c1cccnc1
InChIInChI=1S/C12H18N2/c1-10(7-11-4-6-14-8-11)12-3-2-5-13-9-12/h2-3,5,9-11,14H,4,6-8H2,1H3
InChIKeyIHUUAAGLUPNLMY-UHFFFAOYSA-N
XLogP2.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
CID 83907315
(3R)-3-[(2R)-2-phenylpropyl]pyrrolidine
CID 86324114
2-methyl-5-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
CID 83908693
(3S)-3-[(2S)-2-(3-methoxyphenyl)propyl]pyrrolidine
CID 58422845
N-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 79724749
3-(1-pyrrolidin-3-ylpropan-2-yl)phenol
CID 83908768
3-[2-(4-methylphenyl)propyl]pyrrolidine
CID 83908593
3-(2-methyl-1-pyrrolidin-3-ylpropyl)pyridine
CID 83908706
2-(1-pyrrolidin-3-ylpropan-2-yl)phenol
CID 83908767
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
4-[1-[(3S)-pyrrolidin-3-yl]butan-2-yl]pyridine
CID 139296538
3-(1-piperidin-4-ylpropyl)pyridine
CID 83908701

Frequently Asked Questions

What is the IUPAC name of 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine?
The IUPAC name of 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine (CID 83907317) is 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine.
What is the SMILES notation for 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine?
The canonical SMILES for 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine is CC(CC1CCNC1)c1cccnc1.
What is the InChIKey of 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine?
The InChIKey is IHUUAAGLUPNLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-10(7-11-4-6-14-8-11)12-3-2-5-13-9-12/h2-3,5,9-11,14H,4,6-8H2,1H3.
What are the key properties of 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine?
3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine is sourced from PubChem (CID 83907317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).