bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline

C94H127N17O — CID 159307852

IUPACbis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2cncnc2c1.Cc1ccc2nccnc2c1.Cc1cccc2cncnc12.Cc1cccc2nccnc12.Cc1ccnc2cccnc12.Cc1ccnc2ccncc12.Cc1nc2ccccn2c1C.Cc1nc2ccccn2c1C.Cc1ncco1
InChIInChI=1S/2C9H10N2.6C9H8N2.C4H5NO.9C2H6/c2*1-7-8(2)11-6-4-3-5-9(11)10-7;1-7-2-5-11-9-3-4-10-6-8(7)9;1-7-2-3-8-5-10-6-11-9(8)4-7;1-7-2-3-8-9(6-7)11-5-4-10-8;1-7-4-6-10-8-3-2-5-11-9(7)8;1-7-3-2-4-8-5-10-6-11-9(7)8;1-7-3-2-4-8-9(7)11-6-5-10-8;1-4-5-2-3-6-4;9*1-2/h2*3-6H,1-2H3;6*2-6H,1H3;2-3H,1H3;9*1-2H3
InChIKeyLCDLBHXZCBRBDC-UHFFFAOYSA-N
MW1511.17 g/mol
LogP25.75
Rot. Bonds

About bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline

bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline (PubChem CID 159307852) has the molecular formula C94H127N17O and a molecular weight of 1511.17 g/mol. Its IUPAC name is bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline.

Molecular Properties

Compound Namebis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline
PubChem CID159307852
Molecular FormulaC94H127N17O
Molecular Weight1511.17 g/mol
Exact Mass1510.04
IUPAC Namebis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2cncnc2c1.Cc1ccc2nccnc2c1.Cc1cccc2cncnc12.Cc1cccc2nccnc12.Cc1ccnc2cccnc12.Cc1ccnc2ccncc12.Cc1nc2ccccn2c1C.Cc1nc2ccccn2c1C.Cc1ncco1
InChIInChI=1S/2C9H10N2.6C9H8N2.C4H5NO.9C2H6/c2*1-7-8(2)11-6-4-3-5-9(11)10-7;1-7-2-5-11-9-3-4-10-6-8(7)9;1-7-2-3-8-5-10-6-11-9(8)4-7;1-7-2-3-8-9(6-7)11-5-4-10-8;1-7-4-6-10-8-3-2-5-11-9(7)8;1-7-3-2-4-8-5-10-6-11-9(7)8;1-7-3-2-4-8-9(7)11-6-5-10-8;1-4-5-2-3-6-4;9*1-2/h2*3-6H,1-2H3;6*2-6H,1H3;2-3H,1H3;9*1-2H3
InChIKeyLCDLBHXZCBRBDC-UHFFFAOYSA-N
XLogP25.75
TPSA215.31 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001511.17
LogP ≤ 525.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline with MolForge

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Related Compounds

2-methyl-N-(4-methylphenyl)-5-[3-(1,3-oxazol-2-yl)imidazo[1,5-a]pyridin-8-yl]benzamide;N-(4-methylphenyl)-5-(3-pyrimidin-2-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide
CID 159276022
7-[3-[6-(3-Carbazol-9-ylcarbazol-9-yl)-2-pyridinyl]phenyl]-[1,3]oxazolo[3,2-a]benzimidazole
CID 126749696
2-[2-[(2R,6S)-2-(1H-benzimidazol-2-yl)-6-[4-[2-[(2R,6S)-1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3H-benzimidazol-5-yl]-3-methyl-2-pyridinyl]piperidin-1-yl]ethyl]-1,3-oxazole
CID 145424467
4a,8a-Dihydroquinoxaline;benzimidazol-1-ide;carbazol-9-ide;methane;naphthalene;1,3,4-oxadiazole;1,3-oxazole;1,7-phenanthroline;1,10-phenanthroline;pyridine;pyrrol-1-ide;quinoline;tris(yttrium)
CID 157359835
5-(4-anthracen-9-yl-6-phenyl-1,3,5-triazin-2-yl)-N,N-diphenyl-1,3,4-oxadiazol-2-amine;4-(14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-yl)-7-(4,6-dibenzyl-1,3,5-triazin-2-yl)-2,1,3-benzothiadiazole;N-[4-[4,6-bis(2-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-N-phenylpyren-2-amine;N,N-di(phenanthren-2-yl)-4,6-dipyridin-3-yl-1,3,5-triazin-2-amine;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-N,N-diphenylpyrazin-2-amine;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-N,N-diphenylpyridin-3-amine;4-[(4,6-diphenyl-1,3,5-triazin-2-yl)methyl]-N,N-diphenylaniline;N-[[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]methyl]-N-phenylaniline;4-[4,6-di(quinolin-8-yl)-1,3,5-triazin-2-yl]-N,N-diphenylaniline;9-[4-(4-phenyl-6-pyren-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 157899083
1-[4-[3-[8-Amino-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-3-yl]cyclobutyl]piperazin-1-yl]ethanone;3-[3-[4-(2-methoxyethyl)piperazin-1-yl]cyclobutyl]-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)cyclobutyl]imidazo[1,5-a]pyrazin-8-amine
CID 158705306
CID 160201678
CID 160201678
7-[3-[3-(3-Carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]-[1,3]oxazolo[3,2-a]benzimidazole;7-[4-[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-2-pyridinyl]-[1,3]oxazolo[3,2-a]benzimidazole;7-[3-[6-(3-carbazol-9-ylcarbazol-9-yl)-2-pyridinyl]phenyl]-[1,3]oxazolo[3,2-a]benzimidazole
CID 160381542
1,2-dimethyl-3a,7a-dihydroindole;1,2-dimethyl-5,6-dihydro-4H-pyrimidine;1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine;1,7-dimethyl-3,4-dihydro-2H-quinoline;1,2-dimethylindole;2,5-dimethyl-3H-indole;N,1-dimethyl-3H-indol-2-imine;2,4-dimethylpyrimidine;2,4-dimethyl-3H-pyrrolo[3,2-c]pyridine;ethane;methane;2-methyl-3a,4,5,6,7,7a-hexahydro-3H-indole;3-methyl-1,4,4a,5,6,7,8,8a-octahydroisoquinoline;2-methyl-3H-indole;2-methyl-1,3-oxazole;2-methyl-3,4,5,6-tetrahydrocyclopenta[b]pyrrole;2-methyl-4,5,6,7-tetrahydro-3H-indole;1,3-oxazole;1,2,4,5-tetramethyl-4,5-dihydroimidazole;1,2,4,5-tetramethylimidazole;2,4,5-trimethyl-3,6-dihydrocyclopenta[b]pyrrole;2,4,6-trimethyl-3,5-dihydrocyclopenta[b]pyrrole;2,5,6-trimethyl-3,4-dihydrocyclopenta[b]pyrrole;1,2,5-trimethylimidazole;N,1,6-trimethyl-3H-pyrrolo[2,3-b]pyridin-2-imine;2,4,6-trimethyl-7H-pyrrolo[3,2-d]pyrimidine
CID 160590563
1,3-Dimethylimidazol-1-ium;2-(2,2-dimethylpropyl)-3-methyl-1,3-oxazol-3-ium;1,2-dimethylpyrazol-2-ium;1,4-dimethylquinoxaline-1,4-diium;2-fluoro-1,6-dimethylpyridin-1-ium;1,1,3,3,4,4-hexamethylpyrrolidin-1-ium;1-methylpyridin-1-ium;1-methylquinolin-1-ium;3,5,6,8-tetrafluoro-1,7-dimethylquinolin-1-ium;decafluoride
CID 160696699
13-Methyl-12-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10(15),11,13-octaene;2-methylbenzo[h]quinazoline;2-methyl-1,3,4-oxadiazole;2-methyl-1,3-oxazole;2-methyl-1,10-phenanthroline
CID 160876946
7-[4-[3-(3-Carbazol-9-ylcarbazol-9-yl)phenyl]-2-pyridinyl]-[1,3]oxazolo[3,2-a]benzimidazole;7-[3-[6-(3-carbazol-9-ylcarbazol-9-yl)-2-pyridinyl]phenyl]-[1,3]oxazolo[3,2-a]benzimidazole
CID 161059096

Frequently Asked Questions

What is the IUPAC name of bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline?
The IUPAC name of bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline (CID 159307852) is bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline.
What is the SMILES notation for bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline?
The canonical SMILES for bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline is CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2cncnc2c1.Cc1ccc2nccnc2c1.Cc1cccc2cncnc12.Cc1cccc2nccnc12.Cc1ccnc2cccnc12.Cc1ccnc2ccncc12.Cc1nc2ccccn2c1C.Cc1nc2ccccn2c1C.Cc1ncco1.
What is the InChIKey of bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline?
The InChIKey is LCDLBHXZCBRBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H10N2.6C9H8N2.C4H5NO.9C2H6/c2*1-7-8(2)11-6-4-3-5-9(11)10-7;1-7-2-5-11-9-3-4-10-6-8(7)9;1-7-2-3-8-5-10-6-11-9(8)4-7;1-7-2-3-8-9(6-7)11-5-4-10-8;1-7-4-6-10-8-3-2-5-11-9(7)8;1-7-3-2-4-8-5-10-6-11-9(7)8;1-7-3-2-4-8-9(7)11-6-5-10-8;1-4-5-2-3-6-4;9*1-2/h2*3-6H,1-2H3;6*2-6H,1H3;2-3H,1H3;9*1-2H3.
What are the key properties of bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline?
bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline has a molecular weight of 1511.17 g/mol, XLogP of 25.75, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,3-dimethylimidazo[1,2-a]pyridine);ethane;4-methyl-1,5-naphthyridine;4-methyl-1,6-naphthyridine;2-methyl-1,3-oxazole;7-methylquinazoline;8-methylquinazoline;5-methylquinoxaline;6-methylquinoxaline is sourced from PubChem (CID 159307852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).