N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane

C75H102Cl3F3N18O9S — CID 167558126

About N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane

N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane (PubChem CID 167558126) has the molecular formula C75H102Cl3F3N18O9S and a molecular weight of 1595.18 g/mol. Its IUPAC name is N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane.

Molecular Properties

• Compound Name: N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane
• PubChem CID: 167558126
• Molecular Formula: C75H102Cl3F3N18O9S
• Molecular Weight: 1595.18 g/mol
• Exact Mass: 1592.68
• IUPAC Name: N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane
• SMILES: C.C.C.CC1CCCO1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N(N)CCN)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN(S(=O)(=O)C(F)(F)F)C(C)=N2)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN=C(C)N2)cc1.COC(C)(OC)OC
• InChI: InChI=1S/C22H22ClF3N6O3S.C21H23ClN6O.C19H23ClN6O.C5H12O3.C5H10O.3CH4/c1-3-18-20(30-13-16(23)6-9-19(30)28-18)21(33)27-12-15-4-7-17(8-5-15)31-10-11-32(14(2)29-31)36(34,35)22(24,25)26;1-3-18-20(27-13-16(22)6-9-19(27)25-18)21(29)24-12-15-4-7-17(8-5-15)28-11-10-23-14(2)26-28;1-2-16-18(25-12-14(20)5-8-17(25)24-16)19(27)23-11-13-3-6-15(7-4-13)26(22)10-9-21;1-5(6-2,7-3)8-4;1-5-3-2-4-6-5;;;/h4-9,13H,3,10-12H2,1-2H3,(H,27,33);4-9,13H,3,10-12H2,1-2H3,(H,23,26)(H,24,29);3-8,12H,2,9-11,21-22H2,1H3,(H,23,27);1-4H3;5H,2-4H2,1H3;3*1H4
• InChIKey: DHBXXIHLWOZYQI-UHFFFAOYSA-N
• XLogP: 12.82
• TPSA: 312.01 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 21
• Heavy Atoms: 109
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1595.18
LogP ≤ 5	12.82
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane?

The IUPAC name of N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane (CID 167558126) is N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane.

What is the SMILES notation for N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane?

The canonical SMILES for N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane is C.C.C.CC1CCCO1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N(N)CCN)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN(S(=O)(=O)C(F)(F)F)C(C)=N2)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN=C(C)N2)cc1.COC(C)(OC)OC.

What is the InChIKey of N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane?

The InChIKey is DHBXXIHLWOZYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClF3N6O3S.C21H23ClN6O.C19H23ClN6O.C5H12O3.C5H10O.3CH4/c1-3-18-20(30-13-16(23)6-9-19(30)28-18)21(33)27-12-15-4-7-17(8-5-15)31-10-11-32(14(2)29-31)36(34,35)22(24,25)26;1-3-18-20(27-13-16(22)6-9-19(27)25-18)21(29)24-12-15-4-7-17(8-5-15)28-11-10-23-14(2)26-28;1-2-16-18(25-12-14(20)5-8-17(25)24-16)19(27)23-11-13-3-6-15(7-4-13)26(22)10-9-21;1-5(6-2,7-3)8-4;1-5-3-2-4-6-5;;;/h4-9,13H,3,10-12H2,1-2H3,(H,27,33);4-9,13H,3,10-12H2,1-2H3,(H,23,26)(H,24,29);3-8,12H,2,9-11,21-22H2,1H3,(H,23,27);1-4H3;5H,2-4H2,1H3;3*1H4.

What are the key properties of N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane?

N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane has a molecular weight of 1595.18 g/mol, XLogP of 12.82, 21 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[4-[amino(2-aminoethyl)amino]phenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-(3-methyl-5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;6-chloro-2-ethyl-N-[[4-[3-methyl-4-(trifluoromethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane;2-methyloxolane;1,1,1-trimethoxyethane is sourced from PubChem (CID 167558126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).