methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate

C17H15ClN2O2 — CID 68621160

IUPACmethyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1cc(-c2cccc(Cl)c2)c2nc(C)c(C)n2c1
InChIInChI=1S/C17H15ClN2O2/c1-10-11(2)20-9-13(17(21)22-3)8-15(16(20)19-10)12-5-4-6-14(18)7-12/h4-9H,1-3H3
InChIKeyNEBLKKZSHLUSJD-UHFFFAOYSA-N
MW314.77 g/mol
LogP4.06
Rot. Bonds2

About methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate

methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate (PubChem CID 68621160) has the molecular formula C17H15ClN2O2 and a molecular weight of 314.77 g/mol. Its IUPAC name is methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate
PubChem CID68621160
Molecular FormulaC17H15ClN2O2
Molecular Weight314.77 g/mol
Exact Mass314.08
IUPAC Namemethyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1cc(-c2cccc(Cl)c2)c2nc(C)c(C)n2c1
InChIInChI=1S/C17H15ClN2O2/c1-10-11(2)20-9-13(17(21)22-3)8-15(16(20)19-10)12-5-4-6-14(18)7-12/h4-9H,1-3H3
InChIKeyNEBLKKZSHLUSJD-UHFFFAOYSA-N
XLogP4.06
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.77
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate with MolForge

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Related Compounds

methyl 8-(3-chlorophenyl)-2-methylimidazo[1,2-a]pyridine-6-carboxylate
CID 68619530
[4-[[8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]methyl]phenyl]urea
CID 46215994
methyl 8-amino-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate;hydrochloride
CID 171922468
methyl 4-[8-(3-chlorophenyl)-6-(methoxycarbonyloxymethyl)-2-methylimidazo[1,2-a]pyridin-3-yl]-4H-pyridine-1-carboxylate
CID 68618616
methyl 8-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate
CID 69114654
methyl 3-(3-chlorophenyl)-1-methylpyrrole-2-carboxylate
CID 117222996
methyl 5-(3-chlorophenyl)-6-cyano-3-hydroxypyridine-2-carboxylate
CID 168937747
methyl 2-(3-chlorophenyl)-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxylate
CID 51359973
methyl 5-[[8-(3-chlorophenyl)-2-methylimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxylate
CID 68620729
methyl 4-(3-chlorophenyl)-2-phenyl-1H-imidazole-5-carboxylate
CID 156703620
methyl 3-(3-chlorophenyl)-1,2-thiazole-5-carboxylate
CID 13073226
8-(3-chlorophenyl)-2-methyl-N-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide
CID 70231516

Frequently Asked Questions

What is the IUPAC name of methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate?
The IUPAC name of methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate (CID 68621160) is methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate.
What is the SMILES notation for methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate?
The canonical SMILES for methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate is COC(=O)c1cc(-c2cccc(Cl)c2)c2nc(C)c(C)n2c1.
What is the InChIKey of methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate?
The InChIKey is NEBLKKZSHLUSJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O2/c1-10-11(2)20-9-13(17(21)22-3)8-15(16(20)19-10)12-5-4-6-14(18)7-12/h4-9H,1-3H3.
What are the key properties of methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate?
methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate has a molecular weight of 314.77 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-(3-chlorophenyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxylate is sourced from PubChem (CID 68621160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).