7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride

C73H83Cl10N15O5S2 — CID 157292863

IUPAC7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride
SMILESCOCCN(C)c1cnc2cc(CN)c(-c3ccc(C)cc3C)cn12.COCCc1cn2cc(-c3ccc(Cl)cc3Cl)c(CN)cc2n1.Cl.Cl.Cl.Cl.NCc1cc2ncc(N3CCS(=O)(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl.NCc1cc2ncc(N3CCS(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H26N4O.C18H18Cl2N4O2S.C18H18Cl2N4OS.C17H17Cl2N3O.4ClH/c1-14-5-6-17(15(2)9-14)18-13-24-19(10-16(18)11-21)22-12-20(24)23(3)7-8-25-4;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-27(25,26)6-4-23;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-26(25)6-4-23;1-23-5-4-13-9-22-10-15(11(8-20)6-17(22)21-13)14-3-2-12(18)7-16(14)19;;;;/h5-6,9-10,12-13H,7-8,11,21H2,1-4H3;1-2,7-8,10-11H,3-6,9,21H2;1-2,7-8,10-11H,3-6,9,21H2;2-3,6-7,9-10H,4-5,8,20H2,1H3;4*1H
InChIKeyAZDOECQQQLZGOF-UHFFFAOYSA-N
MW1669.23 g/mol
LogP15.14
Rot. Bonds17

About 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride

7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride (PubChem CID 157292863) has the molecular formula C73H83Cl10N15O5S2 and a molecular weight of 1669.23 g/mol. Its IUPAC name is 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride.

Molecular Properties

Compound Name7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride
PubChem CID157292863
Molecular FormulaC73H83Cl10N15O5S2
Molecular Weight1669.23 g/mol
Exact Mass1663.30
IUPAC Name7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride
SMILESCOCCN(C)c1cnc2cc(CN)c(-c3ccc(C)cc3C)cn12.COCCc1cn2cc(-c3ccc(Cl)cc3Cl)c(CN)cc2n1.Cl.Cl.Cl.Cl.NCc1cc2ncc(N3CCS(=O)(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl.NCc1cc2ncc(N3CCS(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H26N4O.C18H18Cl2N4O2S.C18H18Cl2N4OS.C17H17Cl2N3O.4ClH/c1-14-5-6-17(15(2)9-14)18-13-24-19(10-16(18)11-21)22-12-20(24)23(3)7-8-25-4;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-27(25,26)6-4-23;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-26(25)6-4-23;1-23-5-4-13-9-22-10-15(11(8-20)6-17(22)21-13)14-3-2-12(18)7-16(14)19;;;;/h5-6,9-10,12-13H,7-8,11,21H2,1-4H3;1-2,7-8,10-11H,3-6,9,21H2;1-2,7-8,10-11H,3-6,9,21H2;2-3,6-7,9-10H,4-5,8,20H2,1H3;4*1H
InChIKeyAZDOECQQQLZGOF-UHFFFAOYSA-N
XLogP15.14
TPSA252.67 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms105
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001669.23
LogP ≤ 515.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride?
The IUPAC name of 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride (CID 157292863) is 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride.
What is the SMILES notation for 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride?
The canonical SMILES for 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride is COCCN(C)c1cnc2cc(CN)c(-c3ccc(C)cc3C)cn12.COCCc1cn2cc(-c3ccc(Cl)cc3Cl)c(CN)cc2n1.Cl.Cl.Cl.Cl.NCc1cc2ncc(N3CCS(=O)(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl.NCc1cc2ncc(N3CCS(=O)CC3)n2cc1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride?
The InChIKey is AZDOECQQQLZGOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O.C18H18Cl2N4O2S.C18H18Cl2N4OS.C17H17Cl2N3O.4ClH/c1-14-5-6-17(15(2)9-14)18-13-24-19(10-16(18)11-21)22-12-20(24)23(3)7-8-25-4;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-27(25,26)6-4-23;19-13-1-2-14(16(20)8-13)15-11-24-17(7-12(15)9-21)22-10-18(24)23-3-5-26(25)6-4-23;1-23-5-4-13-9-22-10-15(11(8-20)6-17(22)21-13)14-3-2-12(18)7-16(14)19;;;;/h5-6,9-10,12-13H,7-8,11,21H2,1-4H3;1-2,7-8,10-11H,3-6,9,21H2;1-2,7-8,10-11H,3-6,9,21H2;2-3,6-7,9-10H,4-5,8,20H2,1H3;4*1H.
What are the key properties of 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride?
7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride has a molecular weight of 1669.23 g/mol, XLogP of 15.14, 17 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(aminomethyl)-6-(2,4-dimethylphenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridin-3-amine;[6-(2,4-dichlorophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-2-(2-methoxyethyl)imidazo[1,2-a]pyridin-7-yl]methanamine;[6-(2,4-dichlorophenyl)-3-(1-oxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridin-7-yl]methanamine;tetrahydrochloride is sourced from PubChem (CID 157292863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).