N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide

C96H96N16O4 — CID 160599624

About N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide

N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide (PubChem CID 160599624) has the molecular formula C96H96N16O4 and a molecular weight of 1537.93 g/mol. Its IUPAC name is N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide.

Molecular Properties

• Compound Name: N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide
• PubChem CID: 160599624
• Molecular Formula: C96H96N16O4
• Molecular Weight: 1537.93 g/mol
• Exact Mass: 1536.78
• IUPAC Name: N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide
• SMILES: CNC(=O)c1ccc(CN2CCCc3cc(-c4cc(C)[nH]n4)ccc32)cc1.CNC(=O)c1ccc(CN2CCCc3cc(-c4cn[nH]c4)ccc32)cc1.Cc1cc(-c2ccc3c(c2)CCCN3Cc2ccc(C(=O)Nc3ccccc3)cc2)n[nH]1.O=C(Nc1ccccc1)c1ccc(CN2CCCc3cc(-c4cn[nH]c4)ccc32)cc1
• InChI: InChI=1S/C27H26N4O.C26H24N4O.C22H24N4O.C21H22N4O/c1-19-16-25(30-29-19)22-13-14-26-23(17-22)6-5-15-31(26)18-20-9-11-21(12-10-20)27(32)28-24-7-3-2-4-8-24;31-26(29-24-6-2-1-3-7-24)20-10-8-19(9-11-20)18-30-14-4-5-22-15-21(12-13-25(22)30)23-16-27-28-17-23;1-15-12-20(25-24-15)18-9-10-21-19(13-18)4-3-11-26(21)14-16-5-7-17(8-6-16)22(27)23-2;1-22-21(26)16-6-4-15(5-7-16)14-25-10-2-3-18-11-17(8-9-20(18)25)19-12-23-24-13-19/h2-4,7-14,16-17H,5-6,15,18H2,1H3,(H,28,32)(H,29,30);1-3,6-13,15-17H,4-5,14,18H2,(H,27,28)(H,29,31);5-10,12-13H,3-4,11,14H2,1-2H3,(H,23,27)(H,24,25);4-9,11-13H,2-3,10,14H2,1H3,(H,22,26)(H,23,24)
• InChIKey: RECFPSBDXZURLJ-UHFFFAOYSA-N
• XLogP: 17.96
• TPSA: 244.08 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 12
• Rotatable Bonds: 18
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1537.93
LogP ≤ 5	17.96
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide?

The IUPAC name of N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide (CID 160599624) is N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide.

What is the SMILES notation for N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide?

The canonical SMILES for N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide is CNC(=O)c1ccc(CN2CCCc3cc(-c4cc(C)[nH]n4)ccc32)cc1.CNC(=O)c1ccc(CN2CCCc3cc(-c4cn[nH]c4)ccc32)cc1.Cc1cc(-c2ccc3c(c2)CCCN3Cc2ccc(C(=O)Nc3ccccc3)cc2)n[nH]1.O=C(Nc1ccccc1)c1ccc(CN2CCCc3cc(-c4cn[nH]c4)ccc32)cc1.

What is the InChIKey of N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide?

The InChIKey is RECFPSBDXZURLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N4O.C26H24N4O.C22H24N4O.C21H22N4O/c1-19-16-25(30-29-19)22-13-14-26-23(17-22)6-5-15-31(26)18-20-9-11-21(12-10-20)27(32)28-24-7-3-2-4-8-24;31-26(29-24-6-2-1-3-7-24)20-10-8-19(9-11-20)18-30-14-4-5-22-15-21(12-13-25(22)30)23-16-27-28-17-23;1-15-12-20(25-24-15)18-9-10-21-19(13-18)4-3-11-26(21)14-16-5-7-17(8-6-16)22(27)23-2;1-22-21(26)16-6-4-15(5-7-16)14-25-10-2-3-18-11-17(8-9-20(18)25)19-12-23-24-13-19/h2-4,7-14,16-17H,5-6,15,18H2,1H3,(H,28,32)(H,29,30);1-3,6-13,15-17H,4-5,14,18H2,(H,27,28)(H,29,31);5-10,12-13H,3-4,11,14H2,1-2H3,(H,23,27)(H,24,25);4-9,11-13H,2-3,10,14H2,1H3,(H,22,26)(H,23,24).

What are the key properties of N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide?

N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide has a molecular weight of 1537.93 g/mol, XLogP of 17.96, 18 rotatable bonds, 8 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;N-methyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide;4-[[6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-N-phenylbenzamide;N-phenyl-4-[[6-(1H-pyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzamide is sourced from PubChem (CID 160599624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).