5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C115H118ClN17O10 — CID 159170461

About 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 159170461) has the molecular formula C115H118ClN17O10 and a molecular weight of 1933.77 g/mol. Its IUPAC name is 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• PubChem CID: 159170461
• Molecular Formula: C115H118ClN17O10
• Molecular Weight: 1933.77 g/mol
• Exact Mass: 1931.89
• IUPAC Name: 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
• SMILES: CCOc1ccc(CN2CCc3c(c(C(=O)NCc4cccc5ccccc45)nn3CCO)C2)cc1.Cc1ccc(CN2CCc3c(c(C(=O)NCc4cccc5ccccc45)nn3CCO)C2)cc1Cl.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cccc3cc[nH]c13)CC2.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cccc3ccoc13)CC2
• InChI: InChI=1S/C29H29N5O2.C29H28N4O3.C29H32N4O3.C28H29ClN4O2/c35-16-15-34-26-12-14-33(18-23-9-4-7-21-11-13-30-27(21)23)19-25(26)28(32-34)29(36)31-17-22-8-3-6-20-5-1-2-10-24(20)22;34-15-14-33-26-11-13-32(18-23-9-4-7-21-12-16-36-28(21)23)19-25(26)27(31-33)29(35)30-17-22-8-3-6-20-5-1-2-10-24(20)22;1-2-36-24-12-10-21(11-13-24)19-32-15-14-27-26(20-32)28(31-33(27)16-17-34)29(35)30-18-23-8-5-7-22-6-3-4-9-25(22)23;1-19-9-10-20(15-25(19)29)17-32-12-11-26-24(18-32)27(31-33(26)13-14-34)28(35)30-16-22-7-4-6-21-5-2-3-8-23(21)22/h1-11,13,30,35H,12,14-19H2,(H,31,36);1-10,12,16,34H,11,13-15,17-19H2,(H,30,35);3-13,34H,2,14-20H2,1H3,(H,30,35);2-10,15,34H,11-14,16-18H2,1H3,(H,30,35)
• InChIKey: KLPUMGDBKPXNET-UHFFFAOYSA-N
• XLogP: 16.66
• TPSA: 319.72 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 22
• Rotatable Bonds: 30
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1933.77
LogP ≤ 5	16.66
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The IUPAC name of 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 159170461) is 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

What is the SMILES notation for 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The canonical SMILES for 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is CCOc1ccc(CN2CCc3c(c(C(=O)NCc4cccc5ccccc45)nn3CCO)C2)cc1.Cc1ccc(CN2CCc3c(c(C(=O)NCc4cccc5ccccc45)nn3CCO)C2)cc1Cl.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cccc3cc[nH]c13)CC2.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cccc3ccoc13)CC2.

What is the InChIKey of 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

The InChIKey is KLPUMGDBKPXNET-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29N5O2.C29H28N4O3.C29H32N4O3.C28H29ClN4O2/c35-16-15-34-26-12-14-33(18-23-9-4-7-21-11-13-30-27(21)23)19-25(26)28(32-34)29(36)31-17-22-8-3-6-20-5-1-2-10-24(20)22;34-15-14-33-26-11-13-32(18-23-9-4-7-21-12-16-36-28(21)23)19-25(26)27(31-33)29(35)30-17-22-8-3-6-20-5-1-2-10-24(20)22;1-2-36-24-12-10-21(11-13-24)19-32-15-14-27-26(20-32)28(31-33(27)16-17-34)29(35)30-18-23-8-5-7-22-6-3-4-9-25(22)23;1-19-9-10-20(15-25(19)29)17-32-12-11-26-24(18-32)27(31-33(26)13-14-34)28(35)30-16-22-7-4-6-21-5-2-3-8-23(21)22/h1-11,13,30,35H,12,14-19H2,(H,31,36);1-10,12,16,34H,11,13-15,17-19H2,(H,30,35);3-13,34H,2,14-20H2,1H3,(H,30,35);2-10,15,34H,11-14,16-18H2,1H3,(H,30,35).

What are the key properties of 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?

5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 1933.77 g/mol, XLogP of 16.66, 30 rotatable bonds, 9 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(1-benzofuran-7-ylmethyl)-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(3-chloro-4-methylphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;5-[(4-ethoxyphenyl)methyl]-1-(2-hydroxyethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-7-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 159170461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).