N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine

C96H107Cl3N22O4 — CID 161352292

About N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine

N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine (PubChem CID 161352292) has the molecular formula C96H107Cl3N22O4 and a molecular weight of 1739.42 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine.

Molecular Properties

• Compound Name: N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine
• PubChem CID: 161352292
• Molecular Formula: C96H107Cl3N22O4
• Molecular Weight: 1739.42 g/mol
• Exact Mass: 1736.79
• IUPAC Name: N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine
• SMILES: CCCCN(C)c1nn(-c2ccc(Cl)cc2)c2cnccc12.Cc1ccc(-n2cc(C3CCNCC3)c3c(O)cncc32)cc1.Cc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.NCCNC(=O)C1CCCCN1c1nn(-c2ccc(Cl)cc2)c2cnccc12.O=C(C1CCCCN1c1nn(-c2ccc(Cl)cc2)c2cnccc12)N1CCNCC1
• InChI: InChI=1S/C22H25ClN6O.C20H23ClN6O.C19H21N3O.C18H19N3O.C17H19ClN4/c23-16-4-6-17(7-5-16)29-20-15-25-9-8-18(20)21(26-29)28-12-2-1-3-19(28)22(30)27-13-10-24-11-14-27;21-14-4-6-15(7-5-14)27-18-13-23-10-8-16(18)19(25-27)26-12-2-1-3-17(26)20(28)24-11-9-22;1-13-2-4-15(5-3-13)22-12-16(14-6-8-20-9-7-14)19-17(22)10-21-11-18(19)23;1-14-2-4-15(5-3-14)21-13-18(20-8-10-22-11-9-20)16-6-7-19-12-17(16)21;1-3-4-11-21(2)17-15-9-10-19-12-16(15)22(20-17)14-7-5-13(18)6-8-14/h4-9,15,19,24H,1-3,10-14H2;4-8,10,13,17H,1-3,9,11-12,22H2,(H,24,28);2-5,10-12,14,20,23H,6-9H2,1H3;2-7,12-13H,8-11H2,1H3;5-10,12H,3-4,11H2,1-2H3
• InChIKey: VOBSBCDRFXQRBV-UHFFFAOYSA-N
• XLogP: 16.36
• TPSA: 269.68 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 17
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1739.42
LogP ≤ 5	16.36
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The IUPAC name of N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine (CID 161352292) is N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine.

What is the SMILES notation for N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The canonical SMILES for N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine is CCCCN(C)c1nn(-c2ccc(Cl)cc2)c2cnccc12.Cc1ccc(-n2cc(C3CCNCC3)c3c(O)cncc32)cc1.Cc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.NCCNC(=O)C1CCCCN1c1nn(-c2ccc(Cl)cc2)c2cnccc12.O=C(C1CCCCN1c1nn(-c2ccc(Cl)cc2)c2cnccc12)N1CCNCC1.

What is the InChIKey of N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The InChIKey is VOBSBCDRFXQRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN6O.C20H23ClN6O.C19H21N3O.C18H19N3O.C17H19ClN4/c23-16-4-6-17(7-5-16)29-20-15-25-9-8-18(20)21(26-29)28-12-2-1-3-19(28)22(30)27-13-10-24-11-14-27;21-14-4-6-15(7-5-14)27-18-13-23-10-8-16(18)19(25-27)26-12-2-1-3-17(26)20(28)24-11-9-22;1-13-2-4-15(5-3-13)22-12-16(14-6-8-20-9-7-14)19-17(22)10-21-11-18(19)23;1-14-2-4-15(5-3-14)21-13-18(20-8-10-22-11-9-20)16-6-7-19-12-17(16)21;1-3-4-11-21(2)17-15-9-10-19-12-16(15)22(20-17)14-7-5-13(18)6-8-14/h4-9,15,19,24H,1-3,10-14H2;4-8,10,13,17H,1-3,9,11-12,22H2,(H,24,28);2-5,10-12,14,20,23H,6-9H2,1H3;2-7,12-13H,8-11H2,1H3;5-10,12H,3-4,11H2,1-2H3.

What are the key properties of N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine has a molecular weight of 1739.42 g/mol, XLogP of 16.36, 17 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-2-carboxamide;N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-piperazin-1-ylmethanone;1-(4-methylphenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine is sourced from PubChem (CID 161352292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).