6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C85H104Cl2N24O7S — CID 167710244

IUPAC6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN(C)C(C)=N2)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN=CN2)cc1.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN(S(=O)(=O)CCOC)C=N3)cc1)CCCC2.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN=CN3)cc1)CCCC2
InChIInChI=1S/C23H32N6O4S.C22H25ClN6O.C20H21ClN6O.C20H26N6O/c1-3-20-22(28-11-5-4-6-21(28)26-20)23(30)24-16-18-7-9-19(10-8-18)29-13-12-27(17-25-29)34(31,32)15-14-33-2;1-4-19-21(28-14-17(23)7-10-20(28)25-19)22(30)24-13-16-5-8-18(9-6-16)29-12-11-27(3)15(2)26-29;1-2-17-19(26-12-15(21)5-8-18(26)25-17)20(28)23-11-14-3-6-16(7-4-14)27-10-9-22-13-24-27;1-2-17-19(25-11-4-3-5-18(25)24-17)20(27)22-13-15-6-8-16(9-7-15)26-12-10-21-14-23-26/h7-10,17H,3-6,11-16H2,1-2H3,(H,24,30);5-10,14H,4,11-13H2,1-3H3,(H,24,30);3-8,12-13H,2,9-11H2,1H3,(H,22,24)(H,23,28);6-9,14H,2-5,10-13H2,1H3,(H,21,23)(H,22,27)
InChIKeyZSJYKYVNQBDERI-UHFFFAOYSA-N
MW1676.90 g/mol
LogP10.22
Rot. Bonds24

About 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 167710244) has the molecular formula C85H104Cl2N24O7S and a molecular weight of 1676.90 g/mol. Its IUPAC name is 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID167710244
Molecular FormulaC85H104Cl2N24O7S
Molecular Weight1676.90 g/mol
Exact Mass1674.76
IUPAC Name6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN(C)C(C)=N2)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN=CN2)cc1.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN(S(=O)(=O)CCOC)C=N3)cc1)CCCC2.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN=CN3)cc1)CCCC2
InChIInChI=1S/C23H32N6O4S.C22H25ClN6O.C20H21ClN6O.C20H26N6O/c1-3-20-22(28-11-5-4-6-21(28)26-20)23(30)24-16-18-7-9-19(10-8-18)29-13-12-27(17-25-29)34(31,32)15-14-33-2;1-4-19-21(28-14-17(23)7-10-20(28)25-19)22(30)24-13-16-5-8-18(9-6-16)29-12-11-27(3)15(2)26-29;1-2-17-19(26-12-15(21)5-8-18(26)25-17)20(28)23-11-14-3-6-16(7-4-14)27-10-9-22-13-24-27;1-2-17-19(25-11-4-3-5-18(25)24-17)20(27)22-13-15-6-8-16(9-7-15)26-12-10-21-14-23-26/h7-10,17H,3-6,11-16H2,1-2H3,(H,24,30);5-10,14H,4,11-13H2,1-3H3,(H,24,30);3-8,12-13H,2,9-11H2,1H3,(H,22,24)(H,23,28);6-9,14H,2-5,10-13H2,1H3,(H,21,23)(H,22,27)
InChIKeyZSJYKYVNQBDERI-UHFFFAOYSA-N
XLogP10.22
TPSA322.95 Ų
H-Bond Donors6
H-Bond Acceptors26
Rotatable Bonds24
Heavy Atoms119
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001676.90
LogP ≤ 510.22
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1026

Analyze 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 167710244) is 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN(C)C(C)=N2)cc1.CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCN=CN2)cc1.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN(S(=O)(=O)CCOC)C=N3)cc1)CCCC2.CCc1nc2n(c1C(=O)NCc1ccc(N3CCN=CN3)cc1)CCCC2.
What is the InChIKey of 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ZSJYKYVNQBDERI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N6O4S.C22H25ClN6O.C20H21ClN6O.C20H26N6O/c1-3-20-22(28-11-5-4-6-21(28)26-20)23(30)24-16-18-7-9-19(10-8-18)29-13-12-27(17-25-29)34(31,32)15-14-33-2;1-4-19-21(28-14-17(23)7-10-20(28)25-19)22(30)24-13-16-5-8-18(9-6-16)29-12-11-27(3)15(2)26-29;1-2-17-19(26-12-15(21)5-8-18(26)25-17)20(28)23-11-14-3-6-16(7-4-14)27-10-9-22-13-24-27;1-2-17-19(25-11-4-3-5-18(25)24-17)20(27)22-13-15-6-8-16(9-7-15)26-12-10-21-14-23-26/h7-10,17H,3-6,11-16H2,1-2H3,(H,24,30);5-10,14H,4,11-13H2,1-3H3,(H,24,30);3-8,12-13H,2,9-11H2,1H3,(H,22,24)(H,23,28);6-9,14H,2-5,10-13H2,1H3,(H,21,23)(H,22,27).
What are the key properties of 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 1676.90 g/mol, XLogP of 10.22, 24 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;6-chloro-N-[[4-(3,4-dimethyl-5,6-dihydro-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;N-[[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]methyl]-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide;2-ethyl-N-[[4-[4-(2-methoxyethylsulfonyl)-5,6-dihydro-1,2,4-triazin-1-yl]phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 167710244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).