8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine

C19H18N4S — CID 134042086

IUPAC8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine
SMILESCc1ccccc1-n1ccnc1SCc1cn2cccc(C)c2n1
InChIInChI=1S/C19H18N4S/c1-14-6-3-4-8-17(14)23-11-9-20-19(23)24-13-16-12-22-10-5-7-15(2)18(22)21-16/h3-12H,13H2,1-2H3
InChIKeyMESZSUMWCPCICZ-UHFFFAOYSA-N
MW334.45 g/mol
LogP4.43
Rot. Bonds4

About 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine

8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine (PubChem CID 134042086) has the molecular formula C19H18N4S and a molecular weight of 334.45 g/mol. Its IUPAC name is 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine
PubChem CID134042086
Molecular FormulaC19H18N4S
Molecular Weight334.45 g/mol
Exact Mass334.13
IUPAC Name8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine
SMILESCc1ccccc1-n1ccnc1SCc1cn2cccc(C)c2n1
InChIInChI=1S/C19H18N4S/c1-14-6-3-4-8-17(14)23-11-9-20-19(23)24-13-16-12-22-10-5-7-15(2)18(22)21-16/h3-12H,13H2,1-2H3
InChIKeyMESZSUMWCPCICZ-UHFFFAOYSA-N
XLogP4.43
TPSA35.12 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.45
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine
CID 38015813
8-methyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CID 40663459
2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 24626686
5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,3-thiazol-2-amine
CID 43250010
1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-4-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one
CID 16542913
7-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 51184904
2-[(1-phenylimidazol-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CID 38511832
3-(2-chlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
CID 24674294
4-methyl-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
CID 27060148
2-methyl-3-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]aniline
CID 79143687
3-[1-(2-methylphenyl)imidazol-2-yl]sulfanylpropanoic acid
CID 82133298
2-(1H-benzimidazol-3-ium-2-ylsulfanylmethyl)-8-methylimidazo[1,2-a]pyridine
CID 3375352

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine?
The IUPAC name of 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine (CID 134042086) is 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine is Cc1ccccc1-n1ccnc1SCc1cn2cccc(C)c2n1.
What is the InChIKey of 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine?
The InChIKey is MESZSUMWCPCICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4S/c1-14-6-3-4-8-17(14)23-11-9-20-19(23)24-13-16-12-22-10-5-7-15(2)18(22)21-16/h3-12H,13H2,1-2H3.
What are the key properties of 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine?
8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine has a molecular weight of 334.45 g/mol, XLogP of 4.43, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-[[1-(2-methylphenyl)imidazol-2-yl]sulfanylmethyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 134042086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).