N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate

C124H130FN19O12 — CID 158076235

About N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate

N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate (PubChem CID 158076235) has the molecular formula C124H130FN19O12 and a molecular weight of 2097.52 g/mol. Its IUPAC name is N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate.

Molecular Properties

• Compound Name: N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate
• PubChem CID: 158076235
• Molecular Formula: C124H130FN19O12
• Molecular Weight: 2097.52 g/mol
• Exact Mass: 2096.01
• IUPAC Name: N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate
• SMILES: C.C.COC(=O)c1ccc2c(CN3CCc4c(c(C(=O)NCc5cccc6ccccc56)nn4CCO)C3)c[nH]c2c1.COc1ccc(CN2CCc3c(c(C(=O)NCc4cc(F)cc5ccccc45)nn3CCO)C2)c2ccccc12.COc1ccc2[nH]c(CN3CCc4c(c(C(=O)NCc5cccc6ccccc56)nn4CCO)C3)cc2c1.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cc3ccccc3[nH]1)CC2
• InChI: InChI=1S/C32H31FN4O3.C31H31N5O4.C30H31N5O3.C29H29N5O2.2CH4/c1-40-30-11-10-22(26-8-4-5-9-27(26)30)19-36-13-12-29-28(20-36)31(35-37(29)14-15-38)32(39)34-18-23-17-24(33)16-21-6-2-3-7-25(21)23;1-40-31(39)21-9-10-25-23(17-32-27(25)15-21)18-35-12-11-28-26(19-35)29(34-36(28)13-14-37)30(38)33-16-22-7-4-6-20-5-2-3-8-24(20)22;1-38-24-9-10-27-22(16-24)15-23(32-27)18-34-12-11-28-26(19-34)29(33-35(28)13-14-36)30(37)31-17-21-7-4-6-20-5-2-3-8-25(20)21;35-15-14-34-27-12-13-33(18-23-16-21-7-2-4-11-26(21)31-23)19-25(27)28(32-34)29(36)30-17-22-9-5-8-20-6-1-3-10-24(20)22;;/h2-11,16-17,38H,12-15,18-20H2,1H3,(H,34,39);2-10,15,17,32,37H,11-14,16,18-19H2,1H3,(H,33,38);2-10,15-16,32,36H,11-14,17-19H2,1H3,(H,31,37);1-11,16,31,35H,12-15,17-19H2,(H,30,36);2*1H4
• InChIKey: FMKDRLPAGUJGJA-UHFFFAOYSA-N
• XLogP: 17.88
• TPSA: 373.69 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 24
• Rotatable Bonds: 31
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2097.52
LogP ≤ 5	17.88
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate?

The IUPAC name of N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate (CID 158076235) is N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate.

What is the SMILES notation for N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate?

The canonical SMILES for N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate is C.C.COC(=O)c1ccc2c(CN3CCc4c(c(C(=O)NCc5cccc6ccccc56)nn4CCO)C3)c[nH]c2c1.COc1ccc(CN2CCc3c(c(C(=O)NCc4cc(F)cc5ccccc45)nn3CCO)C2)c2ccccc12.COc1ccc2[nH]c(CN3CCc4c(c(C(=O)NCc5cccc6ccccc56)nn4CCO)C3)cc2c1.O=C(NCc1cccc2ccccc12)c1nn(CCO)c2c1CN(Cc1cc3ccccc3[nH]1)CC2.

What is the InChIKey of N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate?

The InChIKey is FMKDRLPAGUJGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H31FN4O3.C31H31N5O4.C30H31N5O3.C29H29N5O2.2CH4/c1-40-30-11-10-22(26-8-4-5-9-27(26)30)19-36-13-12-29-28(20-36)31(35-37(29)14-15-38)32(39)34-18-23-17-24(33)16-21-6-2-3-7-25(21)23;1-40-31(39)21-9-10-25-23(17-32-27(25)15-21)18-35-12-11-28-26(19-35)29(34-36(28)13-14-37)30(38)33-16-22-7-4-6-20-5-2-3-8-24(20)22;1-38-24-9-10-27-22(16-24)15-23(32-27)18-34-12-11-28-26(19-34)29(33-35(28)13-14-36)30(37)31-17-21-7-4-6-20-5-2-3-8-25(20)21;35-15-14-34-27-12-13-33(18-23-16-21-7-2-4-11-26(21)31-23)19-25(27)28(32-34)29(36)30-17-22-9-5-8-20-6-1-3-10-24(20)22;;/h2-11,16-17,38H,12-15,18-20H2,1H3,(H,34,39);2-10,15,17,32,37H,11-14,16,18-19H2,1H3,(H,33,38);2-10,15-16,32,36H,11-14,17-19H2,1H3,(H,31,37);1-11,16,31,35H,12-15,17-19H2,(H,30,36);2*1H4.

What are the key properties of N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate?

N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate has a molecular weight of 2097.52 g/mol, XLogP of 17.88, 31 rotatable bonds, 11 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3-fluoronaphthalen-1-yl)methyl]-1-(2-hydroxyethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-(1H-indol-2-ylmethyl)-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;1-(2-hydroxyethyl)-5-[(5-methoxy-1H-indol-2-yl)methyl]-N-(naphthalen-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide;methane;methyl 3-[[1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethylcarbamoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]methyl]-1H-indole-6-carboxylate is sourced from PubChem (CID 158076235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).