10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine

C132H110N8O12 — CID 160701231

About 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine

10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine (PubChem CID 160701231) has the molecular formula C132H110N8O12 and a molecular weight of 2000.38 g/mol. Its IUPAC name is 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine.

Molecular Properties

• Compound Name: 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine
• PubChem CID: 160701231
• Molecular Formula: C132H110N8O12
• Molecular Weight: 2000.38 g/mol
• Exact Mass: 1998.82
• IUPAC Name: 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine
• SMILES: COc1ccccc1N1c2ccccc2C(=O)Oc2cc(C)oc21.COc1ccccc1N1c2ccccc2CCCc2cc(C)oc21.COc1ccccc1N1c2ccccc2COc2cc(C)oc21.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1C=C2.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1CC2.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1N=N2
• InChI: InChI=1S/C25H21NO.C25H19NO.C23H17N3O.C21H21NO2.C19H15NO4.C19H17NO3/c2*1-18-17-21-16-15-20-11-5-7-13-23(20)26(25(21)27-18)24-14-8-6-12-22(24)19-9-3-2-4-10-19;1-16-15-20-23(27-16)26(22-14-8-6-12-19(22)24-25-20)21-13-7-5-11-18(21)17-9-3-2-4-10-17;1-15-14-17-10-7-9-16-8-3-4-11-18(16)22(21(17)24-15)19-12-5-6-13-20(19)23-2;1-12-11-17-18(23-12)20(15-9-5-6-10-16(15)22-2)14-8-4-3-7-13(14)19(21)24-17;1-13-11-18-19(23-13)20(16-9-5-6-10-17(16)21-2)15-8-4-3-7-14(15)12-22-18/h2-14,17H,15-16H2,1H3;2-17H,1H3;2-15H,1H3;3-6,8,11-14H,7,9-10H2,1-2H3;3-11H,1-2H3;3-11H,12H2,1-2H3
• InChIKey: RQQJUMGYQLEVSC-UHFFFAOYSA-N
• XLogP: 36.60
• TPSA: 186.22 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 12
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2000.38
LogP ≤ 5	36.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The IUPAC name of 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine (CID 160701231) is 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine.

What is the SMILES notation for 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The canonical SMILES for 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine is COc1ccccc1N1c2ccccc2C(=O)Oc2cc(C)oc21.COc1ccccc1N1c2ccccc2CCCc2cc(C)oc21.COc1ccccc1N1c2ccccc2COc2cc(C)oc21.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1C=C2.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1CC2.Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1N=N2.

What is the InChIKey of 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

The InChIKey is RQQJUMGYQLEVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21NO.C25H19NO.C23H17N3O.C21H21NO2.C19H15NO4.C19H17NO3/c2*1-18-17-21-16-15-20-11-5-7-13-23(20)26(25(21)27-18)24-14-8-6-12-22(24)19-9-3-2-4-10-19;1-16-15-20-23(27-16)26(22-14-8-6-12-19(22)24-25-20)21-13-7-5-11-18(21)17-9-3-2-4-10-17;1-15-14-17-10-7-9-16-8-3-4-11-18(16)22(21(17)24-15)19-12-5-6-13-20(19)23-2;1-12-11-17-18(23-12)20(15-9-5-6-10-16(15)22-2)14-8-4-3-7-13(14)19(21)24-17;1-13-11-18-19(23-13)20(16-9-5-6-10-17(16)21-2)15-8-4-3-7-14(15)12-22-18/h2-14,17H,15-16H2,1H3;2-17H,1H3;2-15H,1H3;3-6,8,11-14H,7,9-10H2,1-2H3;3-11H,1-2H3;3-11H,12H2,1-2H3.

What are the key properties of 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine?

10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine has a molecular weight of 2000.38 g/mol, XLogP of 36.60, 12 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 10-(2-methoxyphenyl)-2-methyl-5H-furo[2,3-b][4,1]benzoxazepine;10-(2-methoxyphenyl)-2-methylfuro[2,3-b][4,1]benzoxazepin-5-one;2-(2-methoxyphenyl)-5-methyl-4-oxa-2-azatricyclo[9.4.0.03,7]pentadeca-1(15),3(7),5,11,13-pentaene;2-methyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[2,3-b][1]benzazepine;2-methyl-10-(2-phenylphenyl)furo[3,2-c][1,2,5]benzotriazepine is sourced from PubChem (CID 160701231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).