(2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride

C76H84Cl7N15O6S4 — CID 159846966

About (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride

(2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride (PubChem CID 159846966) has the molecular formula C76H84Cl7N15O6S4 and a molecular weight of 1680.05 g/mol. Its IUPAC name is (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride.

Molecular Properties

• Compound Name: (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride
• PubChem CID: 159846966
• Molecular Formula: C76H84Cl7N15O6S4
• Molecular Weight: 1680.05 g/mol
• Exact Mass: 1675.34
• IUPAC Name: (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride
• SMILES: COC(C)N(C)C.COc1cc(C)ccc1CNc1ncc(-c2ccnn2-c2c(Cl)cccc2Cl)s1.COc1cc(C)ccc1CNc1ncc(C(=O)/C=C/N(C)C)s1.COc1cc(C)ccc1CNc1ncc(C(C)=O)s1.Cl.NCc1c(Cl)cccc1Cl.Nc1ncc(-c2ccnn2-c2c(Cl)cccc2Cl)s1
• InChI: InChI=1S/C21H18Cl2N4OS.C17H21N3O2S.C14H16N2O2S.C12H8Cl2N4S.C7H7Cl2N.C5H13NO.ClH/c1-13-6-7-14(18(10-13)28-2)11-24-21-25-12-19(29-21)17-8-9-26-27(17)20-15(22)4-3-5-16(20)23;1-12-5-6-13(15(9-12)22-4)10-18-17-19-11-16(23-17)14(21)7-8-20(2)3;1-9-4-5-11(12(6-9)18-3)7-15-14-16-8-13(19-14)10(2)17;13-7-2-1-3-8(14)11(7)18-9(4-5-17-18)10-6-16-12(15)19-10;8-6-2-1-3-7(9)5(6)4-10;1-5(7-4)6(2)3;/h3-10,12H,11H2,1-2H3,(H,24,25);5-9,11H,10H2,1-4H3,(H,18,19);4-6,8H,7H2,1-3H3,(H,15,16);1-6H,(H2,15,16);1-3H,4,10H2;5H,1-4H3;1H/b;8-7+
• InChIKey: XQEKQSIVAPFXMV-OGCONCECSA-N
• XLogP: 20.14
• TPSA: 252.87 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 25
• Rotatable Bonds: 23
• Heavy Atoms: 108
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1680.05
LogP ≤ 5	20.14
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride?

The IUPAC name of (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride (CID 159846966) is (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride.

What is the SMILES notation for (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride?

The canonical SMILES for (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride is COC(C)N(C)C.COc1cc(C)ccc1CNc1ncc(-c2ccnn2-c2c(Cl)cccc2Cl)s1.COc1cc(C)ccc1CNc1ncc(C(=O)/C=C/N(C)C)s1.COc1cc(C)ccc1CNc1ncc(C(C)=O)s1.Cl.NCc1c(Cl)cccc1Cl.Nc1ncc(-c2ccnn2-c2c(Cl)cccc2Cl)s1.

What is the InChIKey of (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride?

The InChIKey is XQEKQSIVAPFXMV-OGCONCECSA-N. The full InChI is InChI=1S/C21H18Cl2N4OS.C17H21N3O2S.C14H16N2O2S.C12H8Cl2N4S.C7H7Cl2N.C5H13NO.ClH/c1-13-6-7-14(18(10-13)28-2)11-24-21-25-12-19(29-21)17-8-9-26-27(17)20-15(22)4-3-5-16(20)23;1-12-5-6-13(15(9-12)22-4)10-18-17-19-11-16(23-17)14(21)7-8-20(2)3;1-9-4-5-11(12(6-9)18-3)7-15-14-16-8-13(19-14)10(2)17;13-7-2-1-3-8(14)11(7)18-9(4-5-17-18)10-6-16-12(15)19-10;8-6-2-1-3-7(9)5(6)4-10;1-5(7-4)6(2)3;/h3-10,12H,11H2,1-2H3,(H,24,25);5-9,11H,10H2,1-4H3,(H,18,19);4-6,8H,7H2,1-3H3,(H,15,16);1-6H,(H2,15,16);1-3H,4,10H2;5H,1-4H3;1H/b;8-7+;;;;;.

What are the key properties of (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride?

(2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride has a molecular weight of 1680.05 g/mol, XLogP of 20.14, 23 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for (2,6-dichlorophenyl)methanamine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-N-[(2-methoxy-4-methylphenyl)methyl]-1,3-thiazol-2-amine;5-[2-(2,6-dichlorophenyl)pyrazol-3-yl]-1,3-thiazol-2-amine;(E)-3-(dimethylamino)-1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]prop-2-en-1-one;1-methoxy-N,N-dimethylethanamine;1-[2-[(2-methoxy-4-methylphenyl)methylamino]-1,3-thiazol-5-yl]ethanone;hydrochloride is sourced from PubChem (CID 159846966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).