1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide

C21H18FN3O3S — CID 122323242

IUPAC1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1ccc(F)cc1
InChIInChI=1S/C21H18FN3O3S/c1-28-20-10-7-16(19-13-25-11-3-2-4-21(25)23-19)12-18(20)24-29(26,27)14-15-5-8-17(22)9-6-15/h2-13,24H,14H2,1H3
InChIKeyBZDDZTRTEZCFTP-UHFFFAOYSA-N
MW411.46 g/mol
LogP4.09
Rot. Bonds6

About 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide

1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide (PubChem CID 122323242) has the molecular formula C21H18FN3O3S and a molecular weight of 411.46 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
PubChem CID122323242
Molecular FormulaC21H18FN3O3S
Molecular Weight411.46 g/mol
Exact Mass411.11
IUPAC Name1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1ccc(F)cc1
InChIInChI=1S/C21H18FN3O3S/c1-28-20-10-7-16(19-13-25-11-3-2-4-21(25)23-19)12-18(20)24-29(26,27)14-15-5-8-17(22)9-6-15/h2-13,24H,14H2,1H3
InChIKeyBZDDZTRTEZCFTP-UHFFFAOYSA-N
XLogP4.09
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.46
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-1-(4-methylphenyl)methanesulfonamide
CID 122323264
1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
CID 122323269
4-chloro-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)benzenesulfonamide
CID 122323097
3-chloro-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 122323277
5-[(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)sulfamoyl]-2-methoxybenzamide
CID 122323270
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)ethanesulfonamide
CID 23608319
2-(4-chlorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)acetamide
CID 122323070
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)methanesulfonamide
CID 122285383
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-2-(4-propan-2-ylsulfonylphenyl)acetamide
CID 122323181
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-3,5-dimethoxybenzamide
CID 122323039
1-(2,5-difluorophenyl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)methanesulfonamide
CID 121149684
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 122283461

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide (CID 122323242) is 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide is COc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The InChIKey is BZDDZTRTEZCFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O3S/c1-28-20-10-7-16(19-13-25-11-3-2-4-21(25)23-19)12-18(20)24-29(26,27)14-15-5-8-17(22)9-6-15/h2-13,24H,14H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide has a molecular weight of 411.46 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide is sourced from PubChem (CID 122323242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).