6-chloro-4-ethenylpyridin-3-ol

C7H6ClNO — CID 74892695

IUPAC6-chloro-4-ethenylpyridin-3-ol
SMILESC=Cc1cc(Cl)ncc1O
InChIInChI=1S/C7H6ClNO/c1-2-5-3-7(8)9-4-6(5)10/h2-4,10H,1H2
InChIKeyUOGVDOBQJASKHD-UHFFFAOYSA-N
MW155.58 g/mol
LogP2.08
Rot. Bonds1

About 6-chloro-4-ethenylpyridin-3-ol

6-chloro-4-ethenylpyridin-3-ol (PubChem CID 74892695) has the molecular formula C7H6ClNO and a molecular weight of 155.58 g/mol. Its IUPAC name is 6-chloro-4-ethenylpyridin-3-ol.

Molecular Properties

Compound Name6-chloro-4-ethenylpyridin-3-ol
PubChem CID74892695
Molecular FormulaC7H6ClNO
Molecular Weight155.58 g/mol
Exact Mass155.01
IUPAC Name6-chloro-4-ethenylpyridin-3-ol
SMILESC=Cc1cc(Cl)ncc1O
InChIInChI=1S/C7H6ClNO/c1-2-5-3-7(8)9-4-6(5)10/h2-4,10H,1H2
InChIKeyUOGVDOBQJASKHD-UHFFFAOYSA-N
XLogP2.08
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.58
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-ethenylpyridin-3-ol?
The IUPAC name of 6-chloro-4-ethenylpyridin-3-ol (CID 74892695) is 6-chloro-4-ethenylpyridin-3-ol.
What is the SMILES notation for 6-chloro-4-ethenylpyridin-3-ol?
The canonical SMILES for 6-chloro-4-ethenylpyridin-3-ol is C=Cc1cc(Cl)ncc1O.
What is the InChIKey of 6-chloro-4-ethenylpyridin-3-ol?
The InChIKey is UOGVDOBQJASKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClNO/c1-2-5-3-7(8)9-4-6(5)10/h2-4,10H,1H2.
What are the key properties of 6-chloro-4-ethenylpyridin-3-ol?
6-chloro-4-ethenylpyridin-3-ol has a molecular weight of 155.58 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-ethenylpyridin-3-ol is sourced from PubChem (CID 74892695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).