5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol

C13H10FN3O — CID 135121918

IUPAC5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol
SMILESOc1ccc(Cn2cnc(F)c2)c2cccnc12
InChIInChI=1S/C13H10FN3O/c14-12-7-17(8-16-12)6-9-3-4-11(18)13-10(9)2-1-5-15-13/h1-5,7-8,18H,6H2
InChIKeyXHVDVFNHQJLOBV-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.32
Rot. Bonds2

About 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol

5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol (PubChem CID 135121918) has the molecular formula C13H10FN3O and a molecular weight of 243.24 g/mol. Its IUPAC name is 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol.

Molecular Properties

Compound Name5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol
PubChem CID135121918
Molecular FormulaC13H10FN3O
Molecular Weight243.24 g/mol
Exact Mass243.08
IUPAC Name5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol
SMILESOc1ccc(Cn2cnc(F)c2)c2cccnc12
InChIInChI=1S/C13H10FN3O/c14-12-7-17(8-16-12)6-9-3-4-11(18)13-10(9)2-1-5-15-13/h1-5,7-8,18H,6H2
InChIKeyXHVDVFNHQJLOBV-UHFFFAOYSA-N
XLogP2.32
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-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 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol?
The IUPAC name of 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol (CID 135121918) is 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol.
What is the SMILES notation for 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol?
The canonical SMILES for 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol is Oc1ccc(Cn2cnc(F)c2)c2cccnc12.
What is the InChIKey of 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol?
The InChIKey is XHVDVFNHQJLOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O/c14-12-7-17(8-16-12)6-9-3-4-11(18)13-10(9)2-1-5-15-13/h1-5,7-8,18H,6H2.
What are the key properties of 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol?
5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol has a molecular weight of 243.24 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluoroimidazol-1-yl)methyl]quinolin-8-ol is sourced from PubChem (CID 135121918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).