3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol

C16H10FN3O — CID 58362447

IUPAC3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol
SMILESOc1ccc2nc3cc(-c4ccc(F)nc4)ccn3c2c1
InChIInChI=1S/C16H10FN3O/c17-15-4-1-11(9-18-15)10-5-6-20-14-8-12(21)2-3-13(14)19-16(20)7-10/h1-9,21H
InChIKeySMIKTEMWQZZHBT-UHFFFAOYSA-N
MW279.27 g/mol
LogP3.39
Rot. Bonds1

About 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol

3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol (PubChem CID 58362447) has the molecular formula C16H10FN3O and a molecular weight of 279.27 g/mol. Its IUPAC name is 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol.

Molecular Properties

Compound Name3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol
PubChem CID58362447
Molecular FormulaC16H10FN3O
Molecular Weight279.27 g/mol
Exact Mass279.08
IUPAC Name3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol
SMILESOc1ccc2nc3cc(-c4ccc(F)nc4)ccn3c2c1
InChIInChI=1S/C16H10FN3O/c17-15-4-1-11(9-18-15)10-5-6-20-14-8-12(21)2-3-13(14)19-16(20)7-10/h1-9,21H
InChIKeySMIKTEMWQZZHBT-UHFFFAOYSA-N
XLogP3.39
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol?
The IUPAC name of 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol (CID 58362447) is 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol.
What is the SMILES notation for 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol?
The canonical SMILES for 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol is Oc1ccc2nc3cc(-c4ccc(F)nc4)ccn3c2c1.
What is the InChIKey of 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol?
The InChIKey is SMIKTEMWQZZHBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3O/c17-15-4-1-11(9-18-15)10-5-6-20-14-8-12(21)2-3-13(14)19-16(20)7-10/h1-9,21H.
What are the key properties of 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol?
3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol has a molecular weight of 279.27 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-3-pyridinyl)pyrido[1,2-a]benzimidazol-8-ol is sourced from PubChem (CID 58362447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).