3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

C106H122Cl6F4N22O6 — CID 158180492

About 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (PubChem CID 158180492) has the molecular formula C106H122Cl6F4N22O6 and a molecular weight of 2089.00 g/mol. Its IUPAC name is 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
• PubChem CID: 158180492
• Molecular Formula: C106H122Cl6F4N22O6
• Molecular Weight: 2089.00 g/mol
• Exact Mass: 2084.80
• IUPAC Name: 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
• SMILES: CC1(c2n[nH]c3c2CN(C(=O)Nc2cccc(Cl)c2)CC3)CCC1.CCC(C)(C)C1=NCC2=C1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCC(F)(F)c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCCC(F)(F)C1=NCC2=C1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCCc1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(C34CCCC3C4)c2C1
• InChI: InChI=1S/C19H21ClN4O.C19H24ClN3O.C18H20ClF2N3O.C18H21ClN4O.C16H17ClF2N4O.C16H19ClN4O/c20-13-4-1-5-14(9-13)21-18(25)24-8-6-16-15(11-24)17(23-22-16)19-7-2-3-12(19)10-19;1-4-19(2,3)17-16-12-23(9-8-13(16)11-21-17)18(24)22-15-7-5-6-14(20)10-15;1-2-7-18(20,21)16-15-11-24(8-6-12(15)10-22-16)17(25)23-14-5-3-4-13(19)9-14;1-18(7-3-8-18)16-14-11-23(9-6-15(14)21-22-16)17(24)20-13-5-2-4-12(19)10-13;1-2-16(18,19)14-12-9-23(7-6-13(12)21-22-14)15(24)20-11-5-3-4-10(17)8-11;1-2-4-14-13-10-21(8-7-15(13)20-19-14)16(22)18-12-6-3-5-11(17)9-12/h1,4-5,9,12H,2-3,6-8,10-11H2,(H,21,25)(H,22,23);5-7,10H,4,8-9,11-12H2,1-3H3,(H,22,24);3-5,9H,2,6-8,10-11H2,1H3,(H,23,25);2,4-5,10H,3,6-9,11H2,1H3,(H,20,24)(H,21,22);3-5,8H,2,6-7,9H2,1H3,(H,20,24)(H,21,22);3,5-6,9H,2,4,7-8,10H2,1H3,(H,18,22)(H,19,20)
• InChIKey: FYNIAGBYSFXLTG-UHFFFAOYSA-N
• XLogP: 25.48
• TPSA: 333.48 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 12
• Rotatable Bonds: 17
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2089.00
LogP ≤ 5	25.48
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The IUPAC name of 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (CID 158180492) is 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

What is the SMILES notation for 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The canonical SMILES for 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is CC1(c2n[nH]c3c2CN(C(=O)Nc2cccc(Cl)c2)CC3)CCC1.CCC(C)(C)C1=NCC2=C1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCC(F)(F)c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCCC(F)(F)C1=NCC2=C1CN(C(=O)Nc1cccc(Cl)c1)CC2.CCCc1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(C34CCCC3C4)c2C1.

What is the InChIKey of 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

The InChIKey is FYNIAGBYSFXLTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O.C19H24ClN3O.C18H20ClF2N3O.C18H21ClN4O.C16H17ClF2N4O.C16H19ClN4O/c20-13-4-1-5-14(9-13)21-18(25)24-8-6-16-15(11-24)17(23-22-16)19-7-2-3-12(19)10-19;1-4-19(2,3)17-16-12-23(9-8-13(16)11-21-17)18(24)22-15-7-5-6-14(20)10-15;1-2-7-18(20,21)16-15-11-24(8-6-12(15)10-22-16)17(25)23-14-5-3-4-13(19)9-14;1-18(7-3-8-18)16-14-11-23(9-6-15(14)21-22-16)17(24)20-13-5-2-4-12(19)10-13;1-2-16(18,19)14-12-9-23(7-6-13(12)21-22-14)15(24)20-11-5-3-4-10(17)8-11;1-2-4-14-13-10-21(8-7-15(13)20-19-14)16(22)18-12-6-3-5-11(17)9-12/h1,4-5,9,12H,2-3,6-8,10-11H2,(H,21,25)(H,22,23);5-7,10H,4,8-9,11-12H2,1-3H3,(H,22,24);3-5,9H,2,6-8,10-11H2,1H3,(H,23,25);2,4-5,10H,3,6-9,11H2,1H3,(H,20,24)(H,21,22);3-5,8H,2,6-7,9H2,1H3,(H,20,24)(H,21,22);3,5-6,9H,2,4,7-8,10H2,1H3,(H,18,22)(H,19,20).

What are the key properties of 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?

3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide has a molecular weight of 2089.00 g/mol, XLogP of 25.48, 17 rotatable bonds, 10 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(1-bicyclo[3.1.0]hexanyl)-N-(3-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluorobutyl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1,1-difluoropropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylbutan-2-yl)-1,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(1-methylcyclobutyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-propyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is sourced from PubChem (CID 158180492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).