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

C102H110Cl2N20O8 — CID 158848813

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

N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide) (PubChem CID 158848813) has the molecular formula C102H110Cl2N20O8 and a molecular weight of 1815.04 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide).

Molecular Properties

• Compound Name: N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide)
• PubChem CID: 158848813
• Molecular Formula: C102H110Cl2N20O8
• Molecular Weight: 1815.04 g/mol
• Exact Mass: 1812.82
• IUPAC Name: N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide)
• SMILES: Cc1cccc(CNC(=O)c2nn(CCO)c3c2CN(Cc2c[nH]c4ccccc24)CC3)c1.Cc1cccc(CNC(=O)c2nn(CCO)c3c2CN(Cc2c[nH]c4ccccc24)CC3)c1.O=C(NCc1ccc(Cl)cc1)c1nn(CCO)c2c1CN(Cc1c[nH]c3ccccc13)CC2.O=C(NCc1cccc(Cl)c1)c1nn(CCO)c2c1CN(Cc1c[nH]c3ccccc13)CC2
• InChI: InChI=1S/2C26H29N5O2.2C25H26ClN5O2/c2*1-18-5-4-6-19(13-18)14-28-26(33)25-22-17-30(10-9-24(22)31(29-25)11-12-32)16-20-15-27-23-8-3-2-7-21(20)23;26-19-5-3-4-17(12-19)13-28-25(33)24-21-16-30(9-8-23(21)31(29-24)10-11-32)15-18-14-27-22-7-2-1-6-20(18)22;26-19-7-5-17(6-8-19)13-28-25(33)24-21-16-30(10-9-23(21)31(29-24)11-12-32)15-18-14-27-22-4-2-1-3-20(18)22/h2*2-8,13,15,27,32H,9-12,14,16-17H2,1H3,(H,28,33);1-7,12,14,27,32H,8-11,13,15-16H2,(H,28,33);1-8,14,27,32H,9-13,15-16H2,(H,28,33)
• InChIKey: IZEICUWKWOHUHO-UHFFFAOYSA-N
• XLogP: 13.30
• TPSA: 344.72 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 20
• Rotatable Bonds: 28
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1815.04
LogP ≤ 5	13.30
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

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

The IUPAC name of N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide) (CID 158848813) is N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide).

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

The canonical SMILES for N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide) is Cc1cccc(CNC(=O)c2nn(CCO)c3c2CN(Cc2c[nH]c4ccccc24)CC3)c1.Cc1cccc(CNC(=O)c2nn(CCO)c3c2CN(Cc2c[nH]c4ccccc24)CC3)c1.O=C(NCc1ccc(Cl)cc1)c1nn(CCO)c2c1CN(Cc1c[nH]c3ccccc13)CC2.O=C(NCc1cccc(Cl)c1)c1nn(CCO)c2c1CN(Cc1c[nH]c3ccccc13)CC2.

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

The InChIKey is IZEICUWKWOHUHO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H29N5O2.2C25H26ClN5O2/c2*1-18-5-4-6-19(13-18)14-28-26(33)25-22-17-30(10-9-24(22)31(29-25)11-12-32)16-20-15-27-23-8-3-2-7-21(20)23;26-19-5-3-4-17(12-19)13-28-25(33)24-21-16-30(9-8-23(21)31(29-24)10-11-32)15-18-14-27-22-7-2-1-6-20(18)22;26-19-7-5-17(6-8-19)13-28-25(33)24-21-16-30(10-9-23(21)31(29-24)11-12-32)15-18-14-27-22-4-2-1-3-20(18)22/h2*2-8,13,15,27,32H,9-12,14,16-17H2,1H3,(H,28,33);1-7,12,14,27,32H,8-11,13,15-16H2,(H,28,33);1-8,14,27,32H,9-13,15-16H2,(H,28,33).

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

N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide) has a molecular weight of 1815.04 g/mol, XLogP of 13.30, 28 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;bis(1-(2-hydroxyethyl)-5-(1H-indol-3-ylmethyl)-N-[(3-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide) is sourced from PubChem (CID 158848813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).