[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol

C10H14N2O — CID 125041634

IUPAC[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol
SMILESOC[C@]1(c2ccccn2)CCNC1
InChIInChI=1S/C10H14N2O/c13-8-10(4-6-11-7-10)9-3-1-2-5-12-9/h1-3,5,11,13H,4,6-8H2/t10-/m0/s1
InChIKeyNNAVHWUIFSXSBV-JTQLQIEISA-N
MW178.24 g/mol
LogP0.31
Rot. Bonds2

About [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol

[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol (PubChem CID 125041634) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol
PubChem CID125041634
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol
SMILESOC[C@]1(c2ccccn2)CCNC1
InChIInChI=1S/C10H14N2O/c13-8-10(4-6-11-7-10)9-3-1-2-5-12-9/h1-3,5,11,13H,4,6-8H2/t10-/m0/s1
InChIKeyNNAVHWUIFSXSBV-JTQLQIEISA-N
XLogP0.31
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol?
The IUPAC name of [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol (CID 125041634) is [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol?
The canonical SMILES for [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol is OC[C@]1(c2ccccn2)CCNC1.
What is the InChIKey of [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol?
The InChIKey is NNAVHWUIFSXSBV-JTQLQIEISA-N. The full InChI is InChI=1S/C10H14N2O/c13-8-10(4-6-11-7-10)9-3-1-2-5-12-9/h1-3,5,11,13H,4,6-8H2/t10-/m0/s1.
What are the key properties of [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol?
[(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol has a molecular weight of 178.24 g/mol, XLogP of 0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-pyridin-2-ylpyrrolidin-3-yl]methanol is sourced from PubChem (CID 125041634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).