1-pyridin-3-ylpyrrolidin-2-ol

C9H12N2O — CID 139888349

IUPAC1-pyridin-3-ylpyrrolidin-2-ol
SMILESOC1CCCN1c1cccnc1
InChIInChI=1S/C9H12N2O/c12-9-4-2-6-11(9)8-3-1-5-10-7-8/h1,3,5,7,9,12H,2,4,6H2
InChIKeyPUPUTUWEISPMOQ-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.00
Rot. Bonds1

About 1-pyridin-3-ylpyrrolidin-2-ol

1-pyridin-3-ylpyrrolidin-2-ol (PubChem CID 139888349) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 1-pyridin-3-ylpyrrolidin-2-ol.

Molecular Properties

Compound Name1-pyridin-3-ylpyrrolidin-2-ol
PubChem CID139888349
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name1-pyridin-3-ylpyrrolidin-2-ol
SMILESOC1CCCN1c1cccnc1
InChIInChI=1S/C9H12N2O/c12-9-4-2-6-11(9)8-3-1-5-10-7-8/h1,3,5,7,9,12H,2,4,6H2
InChIKeyPUPUTUWEISPMOQ-UHFFFAOYSA-N
XLogP1.00
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-pyridin-3-ylpyrrolidin-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-pyridin-3-ylpyrrolidin-2-amine
CID 54403911
[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol
CID 86336410
methyl (2R)-1-pyridin-3-ylpyrrolidine-2-carboxylate
CID 96706511
(3R)-1-pyridin-3-ylpiperidine-3-carboxylic acid
CID 86332569
3-(3-methylpiperidin-1-yl)pyridine
CID 139386622
1-(3-bromo-4-pyridinyl)piperidin-2-ol
CID 130114596
1-(5-amino-3-pyridinyl)piperidin-2-ol
CID 130114547
(3S)-1-pyridin-3-ylpiperidine-3-carbonitrile
CID 86336417
(1-pyridin-3-ylpiperidin-3-yl)methanamine
CID 83818099
tert-butyl N-methyl-N-(1-pyridin-3-ylpiperidin-2-yl)carbamate
CID 69206152
1-pyridin-3-ylpyrrolidine-3-carboxylic acid
CID 51063831
1-(5-methylpyrazin-2-yl)pyrrolidin-2-ol
CID 123922310

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-ylpyrrolidin-2-ol?
The IUPAC name of 1-pyridin-3-ylpyrrolidin-2-ol (CID 139888349) is 1-pyridin-3-ylpyrrolidin-2-ol.
What is the SMILES notation for 1-pyridin-3-ylpyrrolidin-2-ol?
The canonical SMILES for 1-pyridin-3-ylpyrrolidin-2-ol is OC1CCCN1c1cccnc1.
What is the InChIKey of 1-pyridin-3-ylpyrrolidin-2-ol?
The InChIKey is PUPUTUWEISPMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c12-9-4-2-6-11(9)8-3-1-5-10-7-8/h1,3,5,7,9,12H,2,4,6H2.
What are the key properties of 1-pyridin-3-ylpyrrolidin-2-ol?
1-pyridin-3-ylpyrrolidin-2-ol has a molecular weight of 164.21 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-ylpyrrolidin-2-ol is sourced from PubChem (CID 139888349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).