2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol

C13H9Cl2NO — CID 18763136

IUPAC2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol
SMILESOc1cccnc1/C=C/c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H9Cl2NO/c14-10-6-9(7-11(15)8-10)3-4-12-13(17)2-1-5-16-12/h1-8,17H/b4-3+
InChIKeyUNXJSNSIEMXAEN-ONEGZZNKSA-N
MW266.13 g/mol
LogP4.26
Rot. Bonds2

About 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol

2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol (PubChem CID 18763136) has the molecular formula C13H9Cl2NO and a molecular weight of 266.13 g/mol. Its IUPAC name is 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol.

Molecular Properties

Compound Name2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol
PubChem CID18763136
Molecular FormulaC13H9Cl2NO
Molecular Weight266.13 g/mol
Exact Mass265.01
IUPAC Name2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol
SMILESOc1cccnc1/C=C/c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H9Cl2NO/c14-10-6-9(7-11(15)8-10)3-4-12-13(17)2-1-5-16-12/h1-8,17H/b4-3+
InChIKeyUNXJSNSIEMXAEN-ONEGZZNKSA-N
XLogP4.26
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.13
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol?
The IUPAC name of 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol (CID 18763136) is 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol.
What is the SMILES notation for 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol?
The canonical SMILES for 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol is Oc1cccnc1/C=C/c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol?
The InChIKey is UNXJSNSIEMXAEN-ONEGZZNKSA-N. The full InChI is InChI=1S/C13H9Cl2NO/c14-10-6-9(7-11(15)8-10)3-4-12-13(17)2-1-5-16-12/h1-8,17H/b4-3+.
What are the key properties of 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol?
2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol has a molecular weight of 266.13 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(3,5-dichlorophenyl)ethenyl]pyridin-3-ol is sourced from PubChem (CID 18763136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).