(3-phenoxy-4-pyridinyl)methanol

C12H11NO2 — CID 14044058

IUPAC(3-phenoxy-4-pyridinyl)methanol
SMILESOCc1ccncc1Oc1ccccc1
InChIInChI=1S/C12H11NO2/c14-9-10-6-7-13-8-12(10)15-11-4-2-1-3-5-11/h1-8,14H,9H2
InChIKeyPDXLLVWFBFRVTI-UHFFFAOYSA-N
MW201.23 g/mol
LogP2.37
Rot. Bonds3

About (3-phenoxy-4-pyridinyl)methanol

(3-phenoxy-4-pyridinyl)methanol (PubChem CID 14044058) has the molecular formula C12H11NO2 and a molecular weight of 201.23 g/mol. Its IUPAC name is (3-phenoxy-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3-phenoxy-4-pyridinyl)methanol
PubChem CID14044058
Molecular FormulaC12H11NO2
Molecular Weight201.23 g/mol
Exact Mass201.08
IUPAC Name(3-phenoxy-4-pyridinyl)methanol
SMILESOCc1ccncc1Oc1ccccc1
InChIInChI=1S/C12H11NO2/c14-9-10-6-7-13-8-12(10)15-11-4-2-1-3-5-11/h1-8,14H,9H2
InChIKeyPDXLLVWFBFRVTI-UHFFFAOYSA-N
XLogP2.37
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-phenoxy-4-pyridinyl)methanol?
The IUPAC name of (3-phenoxy-4-pyridinyl)methanol (CID 14044058) is (3-phenoxy-4-pyridinyl)methanol.
What is the SMILES notation for (3-phenoxy-4-pyridinyl)methanol?
The canonical SMILES for (3-phenoxy-4-pyridinyl)methanol is OCc1ccncc1Oc1ccccc1.
What is the InChIKey of (3-phenoxy-4-pyridinyl)methanol?
The InChIKey is PDXLLVWFBFRVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-9-10-6-7-13-8-12(10)15-11-4-2-1-3-5-11/h1-8,14H,9H2.
What are the key properties of (3-phenoxy-4-pyridinyl)methanol?
(3-phenoxy-4-pyridinyl)methanol has a molecular weight of 201.23 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenoxy-4-pyridinyl)methanol is sourced from PubChem (CID 14044058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).