N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine

C94H96Cl3FN18O3 — CID 159634482

About N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine

N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine (PubChem CID 159634482) has the molecular formula C94H96Cl3FN18O3 and a molecular weight of 1651.28 g/mol. Its IUPAC name is N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine.

Molecular Properties

• Compound Name: N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine
• PubChem CID: 159634482
• Molecular Formula: C94H96Cl3FN18O3
• Molecular Weight: 1651.28 g/mol
• Exact Mass: 1648.70
• IUPAC Name: N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine
• SMILES: CCCCN(C)c1nn(-c2ccc(Cl)cc2)c2cnccc12.Cc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2nc(C3CCN(Cc4cccnc4)CC3)c3ccncc32)cc1.FCc1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.Oc1cncc2c1c(C1CCNCC1)cn2-c1ccc(Cl)cc1
• InChI: InChI=1S/C23H22ClN5.C18H18ClN3O.C18H18FN3O.C18H19N3O.C17H19ClN4/c24-19-3-5-20(6-4-19)29-22-15-26-11-7-21(22)23(27-29)18-8-12-28(13-9-18)16-17-2-1-10-25-14-17;19-13-1-3-14(4-2-13)22-11-15(12-5-7-20-8-6-12)18-16(22)9-21-10-17(18)23;19-11-13-1-3-15(4-2-13)22-17-12-20-8-5-16(17)18(21-22)14-6-9-23-10-7-14;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/h1-7,10-11,14-15,18H,8-9,12-13,16H2;1-4,9-12,20,23H,5-8H2;1-5,8,12,14H,6-7,9-11H2;2-7,12-13H,8-11H2,1H3;5-10,12H,3-4,11H2,1-2H3
• InChIKey: MPOGECSYVXHLLF-UHFFFAOYSA-N
• XLogP: 19.96
• TPSA: 201.10 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 21
• Rotatable Bonds: 16
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1651.28
LogP ≤ 5	19.96
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The IUPAC name of N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine (CID 159634482) is N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine.

What is the SMILES notation for N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The canonical SMILES for N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine is CCCCN(C)c1nn(-c2ccc(Cl)cc2)c2cnccc12.Cc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2nc(C3CCN(Cc4cccnc4)CC3)c3ccncc32)cc1.FCc1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.Oc1cncc2c1c(C1CCNCC1)cn2-c1ccc(Cl)cc1.

What is the InChIKey of N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

The InChIKey is MPOGECSYVXHLLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22ClN5.C18H18ClN3O.C18H18FN3O.C18H19N3O.C17H19ClN4/c24-19-3-5-20(6-4-19)29-22-15-26-11-7-21(22)23(27-29)18-8-12-28(13-9-18)16-17-2-1-10-25-14-17;19-13-1-3-14(4-2-13)22-11-15(12-5-7-20-8-6-12)18-16(22)9-21-10-17(18)23;19-11-13-1-3-15(4-2-13)22-17-12-20-8-5-16(17)18(21-22)14-6-9-23-10-7-14;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/h1-7,10-11,14-15,18H,8-9,12-13,16H2;1-4,9-12,20,23H,5-8H2;1-5,8,12,14H,6-7,9-11H2;2-7,12-13H,8-11H2,1H3;5-10,12H,3-4,11H2,1-2H3.

What are the key properties of N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine?

N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine has a molecular weight of 1651.28 g/mol, XLogP of 19.96, 16 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-1-(4-chlorophenyl)-N-methylpyrazolo[5,4-c]pyridin-3-amine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrrolo[2,3-c]pyridin-4-ol;1-(4-chlorophenyl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-c]pyridine;1-[4-(fluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;4-[1-(4-methylphenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine is sourced from PubChem (CID 159634482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).