6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol

C9H12N2O — CID 55275999

IUPAC6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol
SMILESOc1ccc([C@@H]2CCCN2)nc1
InChIInChI=1S/C9H12N2O/c12-7-3-4-9(11-6-7)8-2-1-5-10-8/h3-4,6,8,10,12H,1-2,5H2/t8-/m0/s1
InChIKeyXHYFZTGUTVLTBP-QMMMGPOBSA-N
MW164.21 g/mol
LogP1.21
Rot. Bonds1

About 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol

6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol (PubChem CID 55275999) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol
PubChem CID55275999
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol
SMILESOc1ccc([C@@H]2CCCN2)nc1
InChIInChI=1S/C9H12N2O/c12-7-3-4-9(11-6-7)8-2-1-5-10-8/h3-4,6,8,10,12H,1-2,5H2/t8-/m0/s1
InChIKeyXHYFZTGUTVLTBP-QMMMGPOBSA-N
XLogP1.21
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol?
The IUPAC name of 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol (CID 55275999) is 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol.
What is the SMILES notation for 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol?
The canonical SMILES for 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol is Oc1ccc([C@@H]2CCCN2)nc1.
What is the InChIKey of 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol?
The InChIKey is XHYFZTGUTVLTBP-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H12N2O/c12-7-3-4-9(11-6-7)8-2-1-5-10-8/h3-4,6,8,10,12H,1-2,5H2/t8-/m0/s1.
What are the key properties of 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol?
6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol has a molecular weight of 164.21 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol is sourced from PubChem (CID 55275999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).