2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol

C13H10ClNO — CID 54048718

IUPAC2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol
SMILESOc1cccnc1C=Cc1ccccc1Cl
InChIInChI=1S/C13H10ClNO/c14-11-5-2-1-4-10(11)7-8-12-13(16)6-3-9-15-12/h1-9,16H
InChIKeyLRJDQVNAVZNULH-UHFFFAOYSA-N
MW231.68 g/mol
LogP3.61
Rot. Bonds2

About 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol

2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol (PubChem CID 54048718) has the molecular formula C13H10ClNO and a molecular weight of 231.68 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol
PubChem CID54048718
Molecular FormulaC13H10ClNO
Molecular Weight231.68 g/mol
Exact Mass231.05
IUPAC Name2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol
SMILESOc1cccnc1C=Cc1ccccc1Cl
InChIInChI=1S/C13H10ClNO/c14-11-5-2-1-4-10(11)7-8-12-13(16)6-3-9-15-12/h1-9,16H
InChIKeyLRJDQVNAVZNULH-UHFFFAOYSA-N
XLogP3.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.68
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol?
The IUPAC name of 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol (CID 54048718) is 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol.
What is the SMILES notation for 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol?
The canonical SMILES for 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol is Oc1cccnc1C=Cc1ccccc1Cl.
What is the InChIKey of 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol?
The InChIKey is LRJDQVNAVZNULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClNO/c14-11-5-2-1-4-10(11)7-8-12-13(16)6-3-9-15-12/h1-9,16H.
What are the key properties of 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol?
2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol has a molecular weight of 231.68 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)ethenyl]pyridin-3-ol is sourced from PubChem (CID 54048718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).