6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone

C48H45Br5N8O3 — CID 91188502

IUPAC6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone
SMILESCC(=O)c1cc(OCc2ccccc2)c2nc(C)c(C)n2c1.Cc1nc2c(Br)cc(Br)cn2c1C.Cc1nc2c(OCc3ccccc3)cc(Br)cn2c1C.Nc1ncc(Br)cc1Br
InChIInChI=1S/C18H18N2O2.C16H15BrN2O.C9H8Br2N2.C5H4Br2N2/c1-12-13(2)20-10-16(14(3)21)9-17(18(20)19-12)22-11-15-7-5-4-6-8-15;1-11-12(2)19-9-14(17)8-15(16(19)18-11)20-10-13-6-4-3-5-7-13;1-5-6(2)13-4-7(10)3-8(11)9(13)12-5;6-3-1-4(7)5(8)9-2-3/h4-10H,11H2,1-3H3;3-9H,10H2,1-2H3;3-4H,1-2H3;1-2H,(H2,8,9)
InChIKeyIYYKZCCLHBEMJG-UHFFFAOYSA-N
MW1181.46 g/mol
LogP13.69
Rot. Bonds7

About 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone

6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone (PubChem CID 91188502) has the molecular formula C48H45Br5N8O3 and a molecular weight of 1181.46 g/mol. Its IUPAC name is 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone.

Molecular Properties

Compound Name6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone
PubChem CID91188502
Molecular FormulaC48H45Br5N8O3
Molecular Weight1181.46 g/mol
Exact Mass1175.95
IUPAC Name6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone
SMILESCC(=O)c1cc(OCc2ccccc2)c2nc(C)c(C)n2c1.Cc1nc2c(Br)cc(Br)cn2c1C.Cc1nc2c(OCc3ccccc3)cc(Br)cn2c1C.Nc1ncc(Br)cc1Br
InChIInChI=1S/C18H18N2O2.C16H15BrN2O.C9H8Br2N2.C5H4Br2N2/c1-12-13(2)20-10-16(14(3)21)9-17(18(20)19-12)22-11-15-7-5-4-6-8-15;1-11-12(2)19-9-14(17)8-15(16(19)18-11)20-10-13-6-4-3-5-7-13;1-5-6(2)13-4-7(10)3-8(11)9(13)12-5;6-3-1-4(7)5(8)9-2-3/h4-10H,11H2,1-3H3;3-9H,10H2,1-2H3;3-4H,1-2H3;1-2H,(H2,8,9)
InChIKeyIYYKZCCLHBEMJG-UHFFFAOYSA-N
XLogP13.69
TPSA126.34 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001181.46
LogP ≤ 513.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone with MolForge

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Related Compounds

Bis(4-amino-1-[8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridin-3-yl]-7,7,7-trifluoro-4-methylheptan-1-one);4-amino-1-[2,6-dimethyl-8-[(2,3,6-trifluorophenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]-7,7,7-trifluoro-4-methylheptan-1-one
CID 161871512
1-(2,3-Dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone
CID 20812189
N-(6-ethyl-2-pyridinyl)-6-[(5-fluoro-3-pyridinyl)oxy]imidazo[1,2-a]pyridine-8-carboxamide;6-[(5-fluoro-3-pyridinyl)oxy]-N-(6-methoxy-2-pyridinyl)imidazo[1,2-a]pyridine-8-carboxamide;molecular hydrogen
CID 144848916
4-Amino-1-[8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridin-3-yl]-6,6-difluoro-4-methylhexan-1-one;4-amino-1-[8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridin-3-yl]-7-fluoro-4-methylheptan-1-one;4-amino-1-[8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridin-3-yl]-6-fluoro-4-methylhexan-1-one
CID 157398932
(6-Methoxyimidazo[1,2-a]pyridin-2-yl)-phenylmethanone;(6-methylimidazo[1,2-a]pyridin-2-yl)-(4-methylphenyl)methanone;(7-methylimidazo[1,2-a]pyridin-2-yl)-phenylmethanone
CID 157561850
4-[2-[6-Bromo-2-[2-(3-fluoro-4-methoxyphenyl)ethyl]imidazo[4,5-b]pyridin-3-yl]ethyl]morpholine;4-[2-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(3-fluoro-4-methoxyphenyl)ethyl]imidazo[4,5-b]pyridin-3-yl]ethyl]morpholine
CID 158172859
6-bromo-2-methyl-8-phenylmethoxyimidazo[1,2-a]pyridine;N,N,2-trimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine-6-carboxamide
CID 158190354
2-(6-Ethyl-2-pyridinyl)-1-[6-(4-methyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]ethanone;2-(5-methoxy-2-pyridinyl)-1-[6-(4-methyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]ethanone;1-[6-(4-methyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]-2-pyridin-2-ylethanone;bis(2-(5-methyl-2-pyridinyl)-1-[6-(4-methyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]ethanone);2-(6-methyl-2-pyridinyl)-1-[6-(4-methyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]ethanone
CID 158299047
sodium;6-bromo-2,3-dimethyl-8-phenylmethoxy-2,3-dihydro-1H-imidazo[1,2-a]pyridin-4-ium;5-bromo-3-phenylmethoxypyridin-2-amine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;ethyl 2,3-dimethyl-8-oxo-6,7-dihydro-5H-imidazo[1,2-a]pyridine-6-carboxylate;ethyl 2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine-6-carboxylate;6-(methoxymethyl)-2,3-dimethyl-6,7-dihydro-5H-imidazo[1,2-a]pyridin-8-one;6-(methoxymethyl)-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;molecular bromine;phenylmethanolate;3-phenylmethoxypyridin-2-amine
CID 158618928
5-Bromopyridin-2-amine;ethyl 6-bromo-3-ethylimidazo[1,2-a]pyridine-2-carboxylate;ethyl 3-bromo-2-oxopentanoate;ethyl 3-ethyl-6-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxylate;3-ethyl-6-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxylic acid;ethyl 2-oxopentanoate
CID 159262525
sodium;6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;5-bromo-3-phenylmethoxypyridin-2-amine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;ethyl 2,3-dimethyl-8-oxo-6,7-dihydro-5H-imidazo[1,2-a]pyridine-6-carboxylate;ethyl 2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine-6-carboxylate;6-(methoxymethyl)-2,3-dimethyl-6,7-dihydro-5H-imidazo[1,2-a]pyridin-8-one;6-(methoxymethyl)-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;molecular bromine;phenylmethanolate;3-phenylmethoxypyridin-2-amine
CID 159513644
lithium;6-acetyl-2,3-dimethyl-6,7-dihydro-5H-imidazo[1,2-a]pyridin-8-one;alumane;6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;5-bromo-3-phenylmethoxypyridin-2-amine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone;ethyl acetate;hydride;methoxyethane;6-(methoxymethyl)-2,3-dimethyl-6,7-dihydro-5H-imidazo[1,2-a]pyridin-8-one;6-(methoxymethyl)-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;molecular bromine;3-phenylmethoxypyridin-2-amine
CID 160105651

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone?
The IUPAC name of 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone (CID 91188502) is 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone.
What is the SMILES notation for 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone?
The canonical SMILES for 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone is CC(=O)c1cc(OCc2ccccc2)c2nc(C)c(C)n2c1.Cc1nc2c(Br)cc(Br)cn2c1C.Cc1nc2c(OCc3ccccc3)cc(Br)cn2c1C.Nc1ncc(Br)cc1Br.
What is the InChIKey of 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone?
The InChIKey is IYYKZCCLHBEMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2.C16H15BrN2O.C9H8Br2N2.C5H4Br2N2/c1-12-13(2)20-10-16(14(3)21)9-17(18(20)19-12)22-11-15-7-5-4-6-8-15;1-11-12(2)19-9-14(17)8-15(16(19)18-11)20-10-13-6-4-3-5-7-13;1-5-6(2)13-4-7(10)3-8(11)9(13)12-5;6-3-1-4(7)5(8)9-2-3/h4-10H,11H2,1-3H3;3-9H,10H2,1-2H3;3-4H,1-2H3;1-2H,(H2,8,9).
What are the key properties of 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone?
6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone has a molecular weight of 1181.46 g/mol, XLogP of 13.69, 7 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridine;6,8-dibromo-2,3-dimethylimidazo[1,2-a]pyridine;3,5-dibromopyridin-2-amine;1-(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-6-yl)ethanone is sourced from PubChem (CID 91188502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).