N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine

C21H18FN3O2S — CID 167713595

IUPACN-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccn2c(Nc3ccc(F)cc3)c(-c3ccc(S(C)(=O)=O)cc3)nc2c1
InChIInChI=1S/C21H18FN3O2S/c1-14-11-12-25-19(13-14)24-20(15-3-9-18(10-4-15)28(2,26)27)21(25)23-17-7-5-16(22)6-8-17/h3-13,23H,1-2H3
InChIKeyHSBUAZGTRMKANB-UHFFFAOYSA-N
MW395.46 g/mol
LogP4.60
Rot. Bonds4

About N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine

N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 167713595) has the molecular formula C21H18FN3O2S and a molecular weight of 395.46 g/mol. Its IUPAC name is N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID167713595
Molecular FormulaC21H18FN3O2S
Molecular Weight395.46 g/mol
Exact Mass395.11
IUPAC NameN-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccn2c(Nc3ccc(F)cc3)c(-c3ccc(S(C)(=O)=O)cc3)nc2c1
InChIInChI=1S/C21H18FN3O2S/c1-14-11-12-25-19(13-14)24-20(15-3-9-18(10-4-15)28(2,26)27)21(25)23-17-7-5-16(22)6-8-17/h3-13,23H,1-2H3
InChIKeyHSBUAZGTRMKANB-UHFFFAOYSA-N
XLogP4.60
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 167713581
N-[2-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-3-methylbut-2-enamide
CID 30708646
2-(4-fluorophenyl)-N-(4-methylphenyl)-7-[(4-methylsulfonylphenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-amine
CID 58179147
4-[[2-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]sulfamoyl]-N,N,1-trimethylpyrrole-2-carboxamide
CID 166350273
N-(4-chlorophenyl)-7-methyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 7337996
2-ethyl-N-[2-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]hexanamide
CID 42694164
5-methyl-2-(4-methylsulfonylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 167713578
4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
CID 25038955
N-(4-fluorophenyl)-7-methyl-2-[5-(2-pyridin-2-ylethynyl)furan-2-yl]imidazo[1,2-a]pyridin-3-amine
CID 69316016
[4-[3-(1,3-benzodioxol-5-ylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl]-trimethylazanium
CID 123546918
7-methyl-N-(4-propan-2-ylphenyl)-2-pyridin-3-ylimidazo[1,2-a]pyridin-3-amine
CID 4625140
ethyl 4-[[2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]benzoate
CID 175772540

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 167713595) is N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine is Cc1ccn2c(Nc3ccc(F)cc3)c(-c3ccc(S(C)(=O)=O)cc3)nc2c1.
What is the InChIKey of N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is HSBUAZGTRMKANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O2S/c1-14-11-12-25-19(13-14)24-20(15-3-9-18(10-4-15)28(2,26)27)21(25)23-17-7-5-16(22)6-8-17/h3-13,23H,1-2H3.
What are the key properties of N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine?
N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 395.46 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-7-methyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 167713595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).