N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

C53H51Cl3N14O4S2 — CID 159010990

About N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-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)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (PubChem CID 159010990) has the molecular formula C53H51Cl3N14O4S2 and a molecular weight of 1118.58 g/mol. Its IUPAC name is N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
• PubChem CID: 159010990
• Molecular Formula: C53H51Cl3N14O4S2
• Molecular Weight: 1118.58 g/mol
• Exact Mass: 1116.27
• IUPAC Name: N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
• SMILES: CC1Cc2c(c(-c3cccs3)nn2C)CN1C(=O)Nc1cccc(Cl)c1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccsc3CO)c2C1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-n3cccn3)c2C1
• InChI: InChI=1S/C19H19ClN4OS.C18H17ClN4O2S.C16H15ClN6O/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;19-11-2-1-3-12(8-11)20-18(25)23-6-4-15-14(9-23)17(22-21-15)13-5-7-26-16(13)10-24;17-11-3-1-4-12(9-11)19-16(24)22-8-5-14-13(10-22)15(21-20-14)23-7-2-6-18-23/h3-8,10,12H,9,11H2,1-2H3,(H,21,25);1-3,5,7-8,24H,4,6,9-10H2,(H,20,25)(H,21,22);1-4,6-7,9H,5,8,10H2,(H,19,24)(H,20,21)
• InChIKey: JSMDZJATIFLRSC-UHFFFAOYSA-N
• XLogP: 11.49
• TPSA: 210.25 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 12
• Rotatable Bonds: 7
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1118.58
LogP ≤ 5	11.49
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The IUPAC name of N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (CID 159010990) is N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

What is the SMILES notation for N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The canonical SMILES for N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is CC1Cc2c(c(-c3cccs3)nn2C)CN1C(=O)Nc1cccc(Cl)c1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccsc3CO)c2C1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-n3cccn3)c2C1.

What is the InChIKey of N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The InChIKey is JSMDZJATIFLRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4OS.C18H17ClN4O2S.C16H15ClN6O/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;19-11-2-1-3-12(8-11)20-18(25)23-6-4-15-14(9-23)17(22-21-15)13-5-7-26-16(13)10-24;17-11-3-1-4-12(9-11)19-16(24)22-8-5-14-13(10-22)15(21-20-14)23-7-2-6-18-23/h3-8,10,12H,9,11H2,1-2H3,(H,21,25);1-3,5,7-8,24H,4,6,9-10H2,(H,20,25)(H,21,22);1-4,6-7,9H,5,8,10H2,(H,19,24)(H,20,21).

What are the key properties of N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-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)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide has a molecular weight of 1118.58 g/mol, XLogP of 11.49, 7 rotatable bonds, 6 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-chlorophenyl)-1,6-dimethyl-3-thiophen-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[2-(hydroxymethyl)thiophen-3-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyrazol-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is sourced from PubChem (CID 159010990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).