6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol

C13H10ClFN2O — CID 86726293

IUPAC6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol
SMILESOc1ccc(Cl)nc1C1Cc2c(F)cccc2N1
InChIInChI=1S/C13H10ClFN2O/c14-12-5-4-11(18)13(17-12)10-6-7-8(15)2-1-3-9(7)16-10/h1-5,10,16,18H,6H2
InChIKeyHQQTXCWEFNFPEZ-UHFFFAOYSA-N
MW264.69 g/mol
LogP3.29
Rot. Bonds1

About 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol

6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol (PubChem CID 86726293) has the molecular formula C13H10ClFN2O and a molecular weight of 264.69 g/mol. Its IUPAC name is 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol
PubChem CID86726293
Molecular FormulaC13H10ClFN2O
Molecular Weight264.69 g/mol
Exact Mass264.05
IUPAC Name6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol
SMILESOc1ccc(Cl)nc1C1Cc2c(F)cccc2N1
InChIInChI=1S/C13H10ClFN2O/c14-12-5-4-11(18)13(17-12)10-6-7-8(15)2-1-3-9(7)16-10/h1-5,10,16,18H,6H2
InChIKeyHQQTXCWEFNFPEZ-UHFFFAOYSA-N
XLogP3.29
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.69
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol?
The IUPAC name of 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol (CID 86726293) is 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol.
What is the SMILES notation for 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol?
The canonical SMILES for 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol is Oc1ccc(Cl)nc1C1Cc2c(F)cccc2N1.
What is the InChIKey of 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol?
The InChIKey is HQQTXCWEFNFPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O/c14-12-5-4-11(18)13(17-12)10-6-7-8(15)2-1-3-9(7)16-10/h1-5,10,16,18H,6H2.
What are the key properties of 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol?
6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol has a molecular weight of 264.69 g/mol, XLogP of 3.29, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-fluoro-2,3-dihydro-1H-indol-2-yl)pyridin-3-ol is sourced from PubChem (CID 86726293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).