6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol

C13H8ClFN2O — CID 90333492

IUPAC6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol
SMILESOc1ccc(Cl)nc1-c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C13H8ClFN2O/c14-12-4-3-11(18)13(17-12)10-6-7-5-8(15)1-2-9(7)16-10/h1-6,16,18H
InChIKeyIWMFWOLSHUZABW-UHFFFAOYSA-N
MW262.67 g/mol
LogP3.73
Rot. Bonds1

About 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol

6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol (PubChem CID 90333492) has the molecular formula C13H8ClFN2O and a molecular weight of 262.67 g/mol. Its IUPAC name is 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol
PubChem CID90333492
Molecular FormulaC13H8ClFN2O
Molecular Weight262.67 g/mol
Exact Mass262.03
IUPAC Name6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol
SMILESOc1ccc(Cl)nc1-c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C13H8ClFN2O/c14-12-4-3-11(18)13(17-12)10-6-7-5-8(15)1-2-9(7)16-10/h1-6,16,18H
InChIKeyIWMFWOLSHUZABW-UHFFFAOYSA-N
XLogP3.73
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.67
LogP ≤ 53.73
H-Bond Donors ≤ 52
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-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol?
The IUPAC name of 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol (CID 90333492) is 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol.
What is the SMILES notation for 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol?
The canonical SMILES for 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol is Oc1ccc(Cl)nc1-c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol?
The InChIKey is IWMFWOLSHUZABW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClFN2O/c14-12-4-3-11(18)13(17-12)10-6-7-5-8(15)1-2-9(7)16-10/h1-6,16,18H.
What are the key properties of 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol?
6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol has a molecular weight of 262.67 g/mol, XLogP of 3.73, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol is sourced from PubChem (CID 90333492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).