4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C22H18FN3O — CID 121055671

IUPAC4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccc(-c2cn3cccc(C)c3n2)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C22H18FN3O/c1-14-5-6-17(20-13-26-11-3-4-15(2)21(26)24-20)12-19(14)25-22(27)16-7-9-18(23)10-8-16/h3-13H,1-2H3,(H,25,27)
InChIKeyWWBMACCQNJSYKR-UHFFFAOYSA-N
MW359.40 g/mol
LogP5.01
Rot. Bonds3

About 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 121055671) has the molecular formula C22H18FN3O and a molecular weight of 359.40 g/mol. Its IUPAC name is 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID121055671
Molecular FormulaC22H18FN3O
Molecular Weight359.40 g/mol
Exact Mass359.14
IUPAC Name4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccc(-c2cn3cccc(C)c3n2)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C22H18FN3O/c1-14-5-6-17(20-13-26-11-3-4-15(2)21(26)24-20)12-19(14)25-22(27)16-7-9-18(23)10-8-16/h3-13H,1-2H3,(H,25,27)
InChIKeyWWBMACCQNJSYKR-UHFFFAOYSA-N
XLogP5.01
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.40
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 121055671) is 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is Cc1ccc(-c2cn3cccc(C)c3n2)cc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is WWBMACCQNJSYKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O/c1-14-5-6-17(20-13-26-11-3-4-15(2)21(26)24-20)12-19(14)25-22(27)16-7-9-18(23)10-8-16/h3-13H,1-2H3,(H,25,27).
What are the key properties of 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 359.40 g/mol, XLogP of 5.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 121055671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).