N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide

C72H70BrCl3FN18O4S4+ — CID 159639222

About N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide

N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide (PubChem CID 159639222) has the molecular formula C72H70BrCl3FN18O4S4+ and a molecular weight of 1585.00 g/mol. Its IUPAC name is N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide.

Molecular Properties

• Compound Name: N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide
• PubChem CID: 159639222
• Molecular Formula: C72H70BrCl3FN18O4S4+
• Molecular Weight: 1585.00 g/mol
• Exact Mass: 1581.29
• IUPAC Name: N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide
• SMILES: CC1Cc2[nH][n+](C)c(-c3cccs3)c2CN1C(=O)Nc1cccc(Cl)c1.CC1Cc2[nH]nc(-c3cscn3)c2CN1C(=O)Nc1ccc(F)c(Cl)c1.CC1Cc2[nH]nc(-c3cscn3)c2CN1C(=O)Nc1cccc(Br)c1.CC1Cc2c(c(-c3cccs3)nn2C)CN1C(=O)Nc1cccc(Cl)c1
• InChI: InChI=1S/2C19H19ClN4OS.C17H16BrN5OS.C17H15ClFN5OS/c1-12-9-16-15(18(22-23(16)2)17-7-4-8-26-17)11-24(12)19(25)21-14-6-3-5-13(20)10-14;1-12-9-16-15(18(23(2)22-16)17-7-4-8-26-17)11-24(12)19(25)21-14-6-3-5-13(20)10-14;1-10-5-14-13(16(22-21-14)15-8-25-9-19-15)7-23(10)17(24)20-12-4-2-3-11(18)6-12;1-9-4-14-11(16(23-22-14)15-7-26-8-20-15)6-24(9)17(25)21-10-2-3-13(19)12(18)5-10/h2*3-8,10,12H,9,11H2,1-2H3,(H,21,25);2-4,6,8-10H,5,7H2,1H3,(H,20,24)(H,21,22);2-3,5,7-9H,4,6H2,1H3,(H,21,25)(H,22,23)/p+1
• InChIKey: ONVPYLNULNRSGB-UHFFFAOYSA-O
• XLogP: 17.56
• TPSA: 249.99 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 14
• Rotatable Bonds: 8
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1585.00
LogP ≤ 5	17.56
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide?

The IUPAC name of N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide (CID 159639222) is N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide.

What is the SMILES notation for N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide?

The canonical SMILES for N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide is CC1Cc2[nH][n+](C)c(-c3cccs3)c2CN1C(=O)Nc1cccc(Cl)c1.CC1Cc2[nH]nc(-c3cscn3)c2CN1C(=O)Nc1ccc(F)c(Cl)c1.CC1Cc2[nH]nc(-c3cscn3)c2CN1C(=O)Nc1cccc(Br)c1.CC1Cc2c(c(-c3cccs3)nn2C)CN1C(=O)Nc1cccc(Cl)c1.

What is the InChIKey of N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide?

The InChIKey is ONVPYLNULNRSGB-UHFFFAOYSA-O. The full InChI is InChI=1S/2C19H19ClN4OS.C17H16BrN5OS.C17H15ClFN5OS/c1-12-9-16-15(18(22-23(16)2)17-7-4-8-26-17)11-24(12)19(25)21-14-6-3-5-13(20)10-14;1-12-9-16-15(18(23(2)22-16)17-7-4-8-26-17)11-24(12)19(25)21-14-6-3-5-13(20)10-14;1-10-5-14-13(16(22-21-14)15-8-25-9-19-15)7-23(10)17(24)20-12-4-2-3-11(18)6-12;1-9-4-14-11(16(23-22-14)15-7-26-8-20-15)6-24(9)17(25)21-10-2-3-13(19)12(18)5-10/h2*3-8,10,12H,9,11H2,1-2H3,(H,21,25);2-4,6,8-10H,5,7H2,1H3,(H,20,24)(H,21,22);2-3,5,7-9H,4,6H2,1H3,(H,21,25)(H,22,23)/p+1.

What are the key properties of N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide?

N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide has a molecular weight of 1585.00 g/mol, XLogP of 17.56, 8 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-bromophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chloro-4-fluorophenyl)-6-methyl-3-(1,3-thiazol-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-2,6-dimethyl-3-thiophen-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-2-ium-5-carboxamide is sourced from PubChem (CID 159639222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).