(E)-1,2-dipyridin-2-ylethene-1,2-diol

C12H10N2O2 — CID 135603839

IUPAC(E)-1,2-dipyridin-2-ylethene-1,2-diol
SMILESO/C(=C(/O)c1ccccn1)c1ccccn1
InChIInChI=1S/C12H10N2O2/c15-11(9-5-1-3-7-13-9)12(16)10-6-2-4-8-14-10/h1-8,15-16H/b12-11+
InChIKeyCQKOWIAZMZUHNW-VAWYXSNFSA-N
MW214.22 g/mol
LogP2.42
Rot. Bonds2

About (E)-1,2-dipyridin-2-ylethene-1,2-diol

(E)-1,2-dipyridin-2-ylethene-1,2-diol (PubChem CID 135603839) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is (E)-1,2-dipyridin-2-ylethene-1,2-diol.

Molecular Properties

Compound Name(E)-1,2-dipyridin-2-ylethene-1,2-diol
PubChem CID135603839
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name(E)-1,2-dipyridin-2-ylethene-1,2-diol
SMILESO/C(=C(/O)c1ccccn1)c1ccccn1
InChIInChI=1S/C12H10N2O2/c15-11(9-5-1-3-7-13-9)12(16)10-6-2-4-8-14-10/h1-8,15-16H/b12-11+
InChIKeyCQKOWIAZMZUHNW-VAWYXSNFSA-N
XLogP2.42
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1,2-dipyridin-2-ylethene-1,2-diol?
The IUPAC name of (E)-1,2-dipyridin-2-ylethene-1,2-diol (CID 135603839) is (E)-1,2-dipyridin-2-ylethene-1,2-diol.
What is the SMILES notation for (E)-1,2-dipyridin-2-ylethene-1,2-diol?
The canonical SMILES for (E)-1,2-dipyridin-2-ylethene-1,2-diol is O/C(=C(/O)c1ccccn1)c1ccccn1.
What is the InChIKey of (E)-1,2-dipyridin-2-ylethene-1,2-diol?
The InChIKey is CQKOWIAZMZUHNW-VAWYXSNFSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-11(9-5-1-3-7-13-9)12(16)10-6-2-4-8-14-10/h1-8,15-16H/b12-11+.
What are the key properties of (E)-1,2-dipyridin-2-ylethene-1,2-diol?
(E)-1,2-dipyridin-2-ylethene-1,2-diol has a molecular weight of 214.22 g/mol, XLogP of 2.42, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2-dipyridin-2-ylethene-1,2-diol is sourced from PubChem (CID 135603839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).