3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol

C14H22N2O — CID 62468527

IUPAC3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol
SMILESOCCCC1CCCN1CCc1ccccn1
InChIInChI=1S/C14H22N2O/c17-12-4-7-14-6-3-10-16(14)11-8-13-5-1-2-9-15-13/h1-2,5,9,14,17H,3-4,6-8,10-12H2
InChIKeyTWGSIKZPAKIYNA-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.86
Rot. Bonds6

About 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol

3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol (PubChem CID 62468527) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol
PubChem CID62468527
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol
SMILESOCCCC1CCCN1CCc1ccccn1
InChIInChI=1S/C14H22N2O/c17-12-4-7-14-6-3-10-16(14)11-8-13-5-1-2-9-15-13/h1-2,5,9,14,17H,3-4,6-8,10-12H2
InChIKeyTWGSIKZPAKIYNA-UHFFFAOYSA-N
XLogP1.86
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-amine
CID 63763018
2-[(2S)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626153
2-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339128
1-(2-pyridin-2-ylethyl)piperidine-2-carbaldehyde
CID 62656596
3-[1-[(2-amino-3-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol
CID 62479564
3-[1-[3-(2-aminophenoxy)propyl]pyrrolidin-2-yl]propan-1-ol
CID 62466981
2-[2-[(2S)-1-[2-(1H-pyrazol-4-yl)ethyl]piperidin-2-yl]ethyl]pyridine
CID 124758900
2-[[(2S)-1-propylpyrrolidin-2-yl]methyl]pyridine
CID 71215497
3-[1-[2-(2-methylphenoxy)ethyl]pyrrolidin-2-yl]propan-1-ol
CID 62467802
1-[(2R)-2-[(2S)-1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 95613097
methyl (2R)-1-(2-pyridin-2-ylethyl)pyrrolidine-2-carboxylate
CID 94335033
3-[1-[3-(2-methylphenoxy)propyl]pyrrolidin-2-yl]propan-1-ol
CID 111103083

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol?
The IUPAC name of 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol (CID 62468527) is 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol?
The canonical SMILES for 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol is OCCCC1CCCN1CCc1ccccn1.
What is the InChIKey of 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol?
The InChIKey is TWGSIKZPAKIYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c17-12-4-7-14-6-3-10-16(14)11-8-13-5-1-2-9-15-13/h1-2,5,9,14,17H,3-4,6-8,10-12H2.
What are the key properties of 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol?
3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 1.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-pyridin-2-ylethyl)pyrrolidin-2-yl]propan-1-ol is sourced from PubChem (CID 62468527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).