N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide

C62H46BrCl4N9O2 — CID 158303533

IUPACN-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide
SMILESCc1ccc(-c2cn3cc(C)cc(NCc4ccccc4)c3n2)cc1.O=C(Nc1cccn2c(Br)c(-c3ccccc3)nc12)c1c(Cl)cccc1Cl.O=C(Nc1cccn2cc(-c3ccccc3)nc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C22H21N3.C20H12BrCl2N3O.C20H13Cl2N3O/c1-16-8-10-19(11-9-16)21-15-25-14-17(2)12-20(22(25)24-21)23-13-18-6-4-3-5-7-18;21-18-17(12-6-2-1-3-7-12)25-19-15(10-5-11-26(18)19)24-20(27)16-13(22)8-4-9-14(16)23;21-14-8-4-9-15(22)18(14)20(26)24-16-10-5-11-25-12-17(23-19(16)25)13-6-2-1-3-7-13/h3-12,14-15,23H,13H2,1-2H3;1-11H,(H,24,27);1-12H,(H,24,26)
InChIKeyGMUDTBBAUDYGQA-UHFFFAOYSA-N
MW1170.83 g/mol
LogP17.11
Rot. Bonds10

About N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide

N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide (PubChem CID 158303533) has the molecular formula C62H46BrCl4N9O2 and a molecular weight of 1170.83 g/mol. Its IUPAC name is N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide.

Molecular Properties

Compound NameN-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide
PubChem CID158303533
Molecular FormulaC62H46BrCl4N9O2
Molecular Weight1170.83 g/mol
Exact Mass1167.17
IUPAC NameN-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide
SMILESCc1ccc(-c2cn3cc(C)cc(NCc4ccccc4)c3n2)cc1.O=C(Nc1cccn2c(Br)c(-c3ccccc3)nc12)c1c(Cl)cccc1Cl.O=C(Nc1cccn2cc(-c3ccccc3)nc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C22H21N3.C20H12BrCl2N3O.C20H13Cl2N3O/c1-16-8-10-19(11-9-16)21-15-25-14-17(2)12-20(22(25)24-21)23-13-18-6-4-3-5-7-18;21-18-17(12-6-2-1-3-7-12)25-19-15(10-5-11-26(18)19)24-20(27)16-13(22)8-4-9-14(16)23;21-14-8-4-9-15(22)18(14)20(26)24-16-10-5-11-25-12-17(23-19(16)25)13-6-2-1-3-7-13/h3-12,14-15,23H,13H2,1-2H3;1-11H,(H,24,27);1-12H,(H,24,26)
InChIKeyGMUDTBBAUDYGQA-UHFFFAOYSA-N
XLogP17.11
TPSA122.13 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001170.83
LogP ≤ 517.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide with MolForge

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Related Compounds

US10793576, Example 72
CID 146177181
2-chloro-N-[3-[3-[2-[3-[2-[(3S)-3-fluoropyrrolidin-1-yl]ethyl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]phenyl]benzamide
CID 67160639
2-chloro-N-[3-[3-[2-[4-(4-ethylpiperazin-1-yl)anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]phenyl]-6-fluorobenzamide
CID 67161024
2-chloro-N-[3-[3-[2-[3-[2-(3-fluoropyrrolidin-1-yl)ethyl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]phenyl]benzamide
CID 77234224
[4-[[3-bromo-6-(2-chlorophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]piperidin-1-yl]-[3-(trifluoromethyl)phenyl]methanone;5-bromo-6-(2-chlorophenyl)-3-iodo-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-cyclohexyl-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-chloro-6-(2-chlorophenyl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3,6-diphenyl-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
CID 160923688
2-chloro-N-[3-[3-[2-[4-(4-propan-2-ylpiperazin-1-yl)anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]phenyl]benzamide
CID 52935206
N-[3-bromo-2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-8-yl]-2,6-dichlorobenzamide
CID 53718477
2,6-dichloro-N-[2-methyl-3-[(4-phenylimidazol-1-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
CID 53761618
N-(3-bromo-2-ethylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide
CID 53994047
2,6-dichloro-N-[2-methyl-3-[(5-phenylimidazol-1-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
CID 54445102
2,6-dichloro-N-[3-(2-imidazol-1-ylethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]benzamide
CID 57001168
2,6-dichloro-N-[2-methyl-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]imidazo[1,2-a]pyridin-8-yl]benzamide
CID 57075757

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide?
The IUPAC name of N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide (CID 158303533) is N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide.
What is the SMILES notation for N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide?
The canonical SMILES for N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide is Cc1ccc(-c2cn3cc(C)cc(NCc4ccccc4)c3n2)cc1.O=C(Nc1cccn2c(Br)c(-c3ccccc3)nc12)c1c(Cl)cccc1Cl.O=C(Nc1cccn2cc(-c3ccccc3)nc12)c1c(Cl)cccc1Cl.
What is the InChIKey of N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide?
The InChIKey is GMUDTBBAUDYGQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3.C20H12BrCl2N3O.C20H13Cl2N3O/c1-16-8-10-19(11-9-16)21-15-25-14-17(2)12-20(22(25)24-21)23-13-18-6-4-3-5-7-18;21-18-17(12-6-2-1-3-7-12)25-19-15(10-5-11-26(18)19)24-20(27)16-13(22)8-4-9-14(16)23;21-14-8-4-9-15(22)18(14)20(26)24-16-10-5-11-25-12-17(23-19(16)25)13-6-2-1-3-7-13/h3-12,14-15,23H,13H2,1-2H3;1-11H,(H,24,27);1-12H,(H,24,26).
What are the key properties of N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide?
N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide has a molecular weight of 1170.83 g/mol, XLogP of 17.11, 10 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-amine;N-(3-bromo-2-phenylimidazo[1,2-a]pyridin-8-yl)-2,6-dichlorobenzamide;2,6-dichloro-N-(2-phenylimidazo[1,2-a]pyridin-8-yl)benzamide is sourced from PubChem (CID 158303533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).