[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol

C20H16FN3O2 — CID 138474219

IUPAC[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol
SMILESCc1cc(-c2ncccc2-c2ccc3cnc(C(O)O)n3c2)ccc1F
InChIInChI=1S/C20H16FN3O2/c1-12-9-13(5-7-17(12)21)18-16(3-2-8-22-18)14-4-6-15-10-23-19(20(25)26)24(15)11-14/h2-11,20,25-26H,1H3
InChIKeyKOYIZUALKSJKJL-UHFFFAOYSA-N
MW349.37 g/mol
LogP3.49
Rot. Bonds3

About [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol

[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol (PubChem CID 138474219) has the molecular formula C20H16FN3O2 and a molecular weight of 349.37 g/mol. Its IUPAC name is [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol.

Molecular Properties

Compound Name[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol
PubChem CID138474219
Molecular FormulaC20H16FN3O2
Molecular Weight349.37 g/mol
Exact Mass349.12
IUPAC Name[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol
SMILESCc1cc(-c2ncccc2-c2ccc3cnc(C(O)O)n3c2)ccc1F
InChIInChI=1S/C20H16FN3O2/c1-12-9-13(5-7-17(12)21)18-16(3-2-8-22-18)14-4-6-15-10-23-19(20(25)26)24(15)11-14/h2-11,20,25-26H,1H3
InChIKeyKOYIZUALKSJKJL-UHFFFAOYSA-N
XLogP3.49
TPSA70.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-phenylimidazo[1,5-a]pyridin-3-amine
CID 175830895
[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol
CID 90094224
7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-3-phenylimidazo[1,5-a]pyridine
CID 90094854
N-[(3S)-3-carbamoyl-2-bicyclo[2.2.1]hept-5-enyl]-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine-3-carboxamide
CID 155646575
1-[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]benzimidazol-1-yl]propan-1-ol
CID 175830957
4-[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]morpholine
CID 90095751
6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 90095592
N-[3-[amino(hydroxy)methyl]phenyl]-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 139495259
N-(4-carbamoylphenyl)-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 90094803
1-[[2-amino-5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]phenyl]methylideneamino]propan-2-ol
CID 139453678
6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1,3-benzothiazole
CID 90094679
6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine
CID 90095810

Frequently Asked Questions

What is the IUPAC name of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol?
The IUPAC name of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol (CID 138474219) is [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol.
What is the SMILES notation for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol?
The canonical SMILES for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol is Cc1cc(-c2ncccc2-c2ccc3cnc(C(O)O)n3c2)ccc1F.
What is the InChIKey of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol?
The InChIKey is KOYIZUALKSJKJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O2/c1-12-9-13(5-7-17(12)21)18-16(3-2-8-22-18)14-4-6-15-10-23-19(20(25)26)24(15)11-14/h2-11,20,25-26H,1H3.
What are the key properties of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol?
[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol has a molecular weight of 349.37 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridin-3-yl]methanediol is sourced from PubChem (CID 138474219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).