2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide

C19H22N4O3S — CID 169414043

IUPAC2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCn1cnc(-c2cccc(OC)c2)c1-c1cccc(C)n1
InChIInChI=1S/C19H22N4O3S/c1-14-6-4-9-17(22-14)19-18(15-7-5-8-16(12-15)26-3)21-13-23(19)10-11-27(24,25)20-2/h4-9,12-13,20H,10-11H2,1-3H3
InChIKeyFFLQGKKQEVJAAT-UHFFFAOYSA-N
MW386.48 g/mol
LogP2.48
Rot. Bonds7

About 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide

2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide (PubChem CID 169414043) has the molecular formula C19H22N4O3S and a molecular weight of 386.48 g/mol. Its IUPAC name is 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide.

Molecular Properties

Compound Name2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide
PubChem CID169414043
Molecular FormulaC19H22N4O3S
Molecular Weight386.48 g/mol
Exact Mass386.14
IUPAC Name2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCn1cnc(-c2cccc(OC)c2)c1-c1cccc(C)n1
InChIInChI=1S/C19H22N4O3S/c1-14-6-4-9-17(22-14)19-18(15-7-5-8-16(12-15)26-3)21-13-23(19)10-11-27(24,25)20-2/h4-9,12-13,20H,10-11H2,1-3H3
InChIKeyFFLQGKKQEVJAAT-UHFFFAOYSA-N
XLogP2.48
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.48
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

formic acid;2-[4-(3-methoxyphenyl)-5-(1-methylpyrazol-3-yl)imidazol-1-yl]-N-methylethanesulfonamide
CID 171339266
3-(3-methoxyphenyl)-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-5-carboxamide
CID 70776702
5-(2-fluoro-3-methoxyphenyl)-1-(2-methylsulfonylethyl)-4-phenylimidazole
CID 50980699
4-[[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)-1H-imidazol-2-yl]methyl]benzamide
CID 59767776
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
1-[3-[(3-methoxyphenyl)methoxy]propyl]-4,5-diphenylimidazole
CID 10179002
2-[3-(3-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(6-methyl-2-pyridinyl)acetamide
CID 51044931
3-(4,5-diphenylimidazol-1-yl)-N-[(Z)-(3-methoxyphenyl)methylideneamino]propanamide
CID 35583303
4-(3-methoxyphenyl)-2,6-dimethylpyrimidine
CID 116897003
4-(3-methoxyphenyl)-2-(6-methyl-2-pyridinyl)-7,8-dihydro-6H-quinazolin-5-one
CID 71276574
2-(3-methoxyphenyl)-N-[4-(6-methyl-2-pyridinyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 176859049
3,5-dichloro-6-(3-methoxyphenyl)-1-methylpyrazin-2-one
CID 13062966

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide?
The IUPAC name of 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide (CID 169414043) is 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide.
What is the SMILES notation for 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide?
The canonical SMILES for 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide is CNS(=O)(=O)CCn1cnc(-c2cccc(OC)c2)c1-c1cccc(C)n1.
What is the InChIKey of 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide?
The InChIKey is FFLQGKKQEVJAAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3S/c1-14-6-4-9-17(22-14)19-18(15-7-5-8-16(12-15)26-3)21-13-23(19)10-11-27(24,25)20-2/h4-9,12-13,20H,10-11H2,1-3H3.
What are the key properties of 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide?
2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide has a molecular weight of 386.48 g/mol, XLogP of 2.48, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-methoxyphenyl)-5-(6-methyl-2-pyridinyl)imidazol-1-yl]-N-methylethanesulfonamide is sourced from PubChem (CID 169414043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).