6-(5-propoxy-3-pyridinyl)pyridin-3-ol

C13H14N2O2 — CID 83129184

IUPAC6-(5-propoxy-3-pyridinyl)pyridin-3-ol
SMILESCCCOc1cncc(-c2ccc(O)cn2)c1
InChIInChI=1S/C13H14N2O2/c1-2-5-17-12-6-10(7-14-9-12)13-4-3-11(16)8-15-13/h3-4,6-9,16H,2,5H2,1H3
InChIKeyAGCWBHHVBHUTHU-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.64
Rot. Bonds4

About 6-(5-propoxy-3-pyridinyl)pyridin-3-ol

6-(5-propoxy-3-pyridinyl)pyridin-3-ol (PubChem CID 83129184) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 6-(5-propoxy-3-pyridinyl)pyridin-3-ol.

Molecular Properties

Compound Name6-(5-propoxy-3-pyridinyl)pyridin-3-ol
PubChem CID83129184
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name6-(5-propoxy-3-pyridinyl)pyridin-3-ol
SMILESCCCOc1cncc(-c2ccc(O)cn2)c1
InChIInChI=1S/C13H14N2O2/c1-2-5-17-12-6-10(7-14-9-12)13-4-3-11(16)8-15-13/h3-4,6-9,16H,2,5H2,1H3
InChIKeyAGCWBHHVBHUTHU-UHFFFAOYSA-N
XLogP2.64
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-propoxy-3-pyridinyl)pyridin-3-ol?
The IUPAC name of 6-(5-propoxy-3-pyridinyl)pyridin-3-ol (CID 83129184) is 6-(5-propoxy-3-pyridinyl)pyridin-3-ol.
What is the SMILES notation for 6-(5-propoxy-3-pyridinyl)pyridin-3-ol?
The canonical SMILES for 6-(5-propoxy-3-pyridinyl)pyridin-3-ol is CCCOc1cncc(-c2ccc(O)cn2)c1.
What is the InChIKey of 6-(5-propoxy-3-pyridinyl)pyridin-3-ol?
The InChIKey is AGCWBHHVBHUTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-2-5-17-12-6-10(7-14-9-12)13-4-3-11(16)8-15-13/h3-4,6-9,16H,2,5H2,1H3.
What are the key properties of 6-(5-propoxy-3-pyridinyl)pyridin-3-ol?
6-(5-propoxy-3-pyridinyl)pyridin-3-ol has a molecular weight of 230.27 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-propoxy-3-pyridinyl)pyridin-3-ol is sourced from PubChem (CID 83129184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).