6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile

C21H11F2N3O2 — CID 135032508

IUPAC6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C21H11F2N3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H
InChIKeyNAYYNDMPHVEFEE-UHFFFAOYSA-N
MW375.33 g/mol
LogP4.09
Rot. Bonds3

About 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile

6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile (PubChem CID 135032508) has the molecular formula C21H11F2N3O2 and a molecular weight of 375.33 g/mol. Its IUPAC name is 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile
PubChem CID135032508
Molecular FormulaC21H11F2N3O2
Molecular Weight375.33 g/mol
Exact Mass375.08
IUPAC Name6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C21H11F2N3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H
InChIKeyNAYYNDMPHVEFEE-UHFFFAOYSA-N
XLogP4.09
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.33
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Aminoimidazo[1,2-a]pyridine deriv. 38
CID 5330617
Aminoimidazo[1,2-a]pyridine deriv. 10
CID 5330632
(2-hydroxyphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 1211941
(5-fluoro-2-hydroxyphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 4884005
3-[3-(4-hydroxyphenyl) imidazo[1,2-a]pyrazin-6-yl]-N,N-dimethyl-benzamide
CID 137120130
Aminoimidazo[1,2-a]pyridine deriv. 11
CID 5330633
2-Hydroxy-5-imidazo[1,2-a]pyridin-2-ylbenzamide
CID 134149357
4-[3-(4-Hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide
CID 145966011
[1-(4-Fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone
CID 154760615
[1-(2-Fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone
CID 156021740
(5-Fluoro-2-hydroxyphenyl)-pyrimido[1,2-a]benzimidazol-3-ylmethanone
CID 3602941
3-[3-(3-Hydroxyphenyl) imidazo[1,2-a]pyrazin-6-yl]benzamide
CID 126673149

Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The IUPAC name of 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile (CID 135032508) is 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile.
What is the SMILES notation for 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The canonical SMILES for 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile is N#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(F)cc3)nc12.
What is the InChIKey of 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The InChIKey is NAYYNDMPHVEFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H11F2N3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H.
What are the key properties of 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile?
6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile has a molecular weight of 375.33 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile is sourced from PubChem (CID 135032508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).