N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine

C97H83ClFN21O — CID 158728767

IUPACN-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine
SMILESCOc1cccc(-c2nc3c(C)nccn3c2Nc2cccc(C)c2)c1.Cc1cccc(Nc2c(-c3ccccc3)nc3c(C)nccn23)c1.Cc1nccn2c(Nc3ccc(Cl)cc3)c(-c3ccccc3)nc12.Cc1nccn2c(Nc3cccc(F)c3)c(-c3ccccc3)nc12.Nc1cccc(Nc2c(-c3ccccc3)nc3cnccn23)c1
InChIInChI=1S/C21H20N4O.C20H18N4.C19H15ClN4.C19H15FN4.C18H15N5/c1-14-6-4-8-17(12-14)23-21-19(16-7-5-9-18(13-16)26-3)24-20-15(2)22-10-11-25(20)21;1-14-7-6-10-17(13-14)22-20-18(16-8-4-3-5-9-16)23-19-15(2)21-11-12-24(19)20;1-13-18-23-17(14-5-3-2-4-6-14)19(24(18)12-11-21-13)22-16-9-7-15(20)8-10-16;1-13-18-23-17(14-6-3-2-4-7-14)19(24(18)11-10-21-13)22-16-9-5-8-15(20)12-16;19-14-7-4-8-15(11-14)21-18-17(13-5-2-1-3-6-13)22-16-12-20-9-10-23(16)18/h4-13,23H,1-3H3;3-13,22H,1-2H3;2*2-12,22H,1H3;1-12,21H,19H2
InChIKeyIKVJOKWIMNRZTR-UHFFFAOYSA-N
MW1613.33 g/mol
LogP22.93
Rot. Bonds16

About N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine

N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine (PubChem CID 158728767) has the molecular formula C97H83ClFN21O and a molecular weight of 1613.33 g/mol. Its IUPAC name is N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine
PubChem CID158728767
Molecular FormulaC97H83ClFN21O
Molecular Weight1613.33 g/mol
Exact Mass1611.68
IUPAC NameN-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine
SMILESCOc1cccc(-c2nc3c(C)nccn3c2Nc2cccc(C)c2)c1.Cc1cccc(Nc2c(-c3ccccc3)nc3c(C)nccn23)c1.Cc1nccn2c(Nc3ccc(Cl)cc3)c(-c3ccccc3)nc12.Cc1nccn2c(Nc3cccc(F)c3)c(-c3ccccc3)nc12.Nc1cccc(Nc2c(-c3ccccc3)nc3cnccn23)c1
InChIInChI=1S/C21H20N4O.C20H18N4.C19H15ClN4.C19H15FN4.C18H15N5/c1-14-6-4-8-17(12-14)23-21-19(16-7-5-9-18(13-16)26-3)24-20-15(2)22-10-11-25(20)21;1-14-7-6-10-17(13-14)22-20-18(16-8-4-3-5-9-16)23-19-15(2)21-11-12-24(19)20;1-13-18-23-17(14-5-3-2-4-6-14)19(24(18)12-11-21-13)22-16-9-7-15(20)8-10-16;1-13-18-23-17(14-6-3-2-4-7-14)19(24(18)11-10-21-13)22-16-9-5-8-15(20)12-16;19-14-7-4-8-15(11-14)21-18-17(13-5-2-1-3-6-13)22-16-12-20-9-10-23(16)18/h4-13,23H,1-3H3;3-13,22H,1-2H3;2*2-12,22H,1H3;1-12,21H,19H2
InChIKeyIKVJOKWIMNRZTR-UHFFFAOYSA-N
XLogP22.93
TPSA246.35 Ų
H-Bond Donors6
H-Bond Acceptors22
Rotatable Bonds16
Heavy Atoms121
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001613.33
LogP ≤ 522.93
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine?
The IUPAC name of N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine (CID 158728767) is N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine.
What is the SMILES notation for N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine?
The canonical SMILES for N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine is COc1cccc(-c2nc3c(C)nccn3c2Nc2cccc(C)c2)c1.Cc1cccc(Nc2c(-c3ccccc3)nc3c(C)nccn23)c1.Cc1nccn2c(Nc3ccc(Cl)cc3)c(-c3ccccc3)nc12.Cc1nccn2c(Nc3cccc(F)c3)c(-c3ccccc3)nc12.Nc1cccc(Nc2c(-c3ccccc3)nc3cnccn23)c1.
What is the InChIKey of N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine?
The InChIKey is IKVJOKWIMNRZTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O.C20H18N4.C19H15ClN4.C19H15FN4.C18H15N5/c1-14-6-4-8-17(12-14)23-21-19(16-7-5-9-18(13-16)26-3)24-20-15(2)22-10-11-25(20)21;1-14-7-6-10-17(13-14)22-20-18(16-8-4-3-5-9-16)23-19-15(2)21-11-12-24(19)20;1-13-18-23-17(14-5-3-2-4-6-14)19(24(18)12-11-21-13)22-16-9-7-15(20)8-10-16;1-13-18-23-17(14-6-3-2-4-7-14)19(24(18)11-10-21-13)22-16-9-5-8-15(20)12-16;19-14-7-4-8-15(11-14)21-18-17(13-5-2-1-3-6-13)22-16-12-20-9-10-23(16)18/h4-13,23H,1-3H3;3-13,22H,1-2H3;2*2-12,22H,1H3;1-12,21H,19H2.
What are the key properties of N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine?
N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine has a molecular weight of 1613.33 g/mol, XLogP of 22.93, 16 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;N-(3-fluorophenyl)-8-methyl-2-phenylimidazo[1,2-a]pyrazin-3-amine;2-(3-methoxyphenyl)-8-methyl-N-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-amine;8-methyl-N-(3-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine;3-N-(2-phenylimidazo[1,2-a]pyrazin-3-yl)benzene-1,3-diamine is sourced from PubChem (CID 158728767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).