9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

C125H95N — CID 160764659

About 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (PubChem CID 160764659) has the molecular formula C125H95N and a molecular weight of 1611.14 g/mol. Its IUPAC name is 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.

Molecular Properties

• Compound Name: 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
• PubChem CID: 160764659
• Molecular Formula: C125H95N
• Molecular Weight: 1611.14 g/mol
• Exact Mass: 1609.75
• IUPAC Name: 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
• SMILES: Cc1ccc2c(c1)-c1c(ccc3c1-c1ccccc1C3)C2.Cc1ccc2c(c1)Cc1ccc3c(c1-2)-c1ccccc1C3.Cc1cccc2c1-c1c(ccc3c1-c1ccccc1C3)C2.Cc1cccc2c1-c1cc3c(cc1C2)Cc1ccccc1-3.Cc1cccc2c1Cc1ccc3c(c1-2)-c1ccccc1C3.Cn1c2ccccc2c2c3c(ccc21)Cc1ccccc1-3
• InChI: InChI=1S/5C21H16.C20H15N/c1-13-5-4-7-15-10-17-11-16-9-14-6-2-3-8-18(14)19(16)12-20(17)21(13)15;1-13-5-4-7-15-12-17-10-9-16-11-14-6-2-3-8-18(14)20(16)21(17)19(13)15;1-13-5-4-8-18-19(13)12-16-10-9-15-11-14-6-2-3-7-17(14)20(15)21(16)18;1-13-6-9-19-17(10-13)12-16-8-7-15-11-14-4-2-3-5-18(14)20(15)21(16)19;1-13-6-7-15-12-17-9-8-16-11-14-4-2-3-5-18(14)20(16)21(17)19(15)10-13;1-21-17-9-5-4-8-16(17)20-18(21)11-10-14-12-13-6-2-3-7-15(13)19(14)20/h2-8,11-12H,9-10H2,1H3;4*2-10H,11-12H2,1H3;2-11H,12H2,1H3
• InChIKey: RYNGRTDMNGFOPJ-UHFFFAOYSA-N
• XLogP: 30.59
• TPSA: 4.93 Ų
• H-Bond Acceptors: 1
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1611.14
LogP ≤ 5	30.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?

The IUPAC name of 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (CID 160764659) is 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.

What is the SMILES notation for 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?

The canonical SMILES for 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is Cc1ccc2c(c1)-c1c(ccc3c1-c1ccccc1C3)C2.Cc1ccc2c(c1)Cc1ccc3c(c1-2)-c1ccccc1C3.Cc1cccc2c1-c1c(ccc3c1-c1ccccc1C3)C2.Cc1cccc2c1-c1cc3c(cc1C2)Cc1ccccc1-3.Cc1cccc2c1Cc1ccc3c(c1-2)-c1ccccc1C3.Cn1c2ccccc2c2c3c(ccc21)Cc1ccccc1-3.

What is the InChIKey of 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?

The InChIKey is RYNGRTDMNGFOPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/5C21H16.C20H15N/c1-13-5-4-7-15-10-17-11-16-9-14-6-2-3-8-18(14)19(16)12-20(17)21(13)15;1-13-5-4-7-15-12-17-10-9-16-11-14-6-2-3-8-18(14)20(16)21(17)19(13)15;1-13-5-4-8-18-19(13)12-16-10-9-15-11-14-6-2-3-7-17(14)20(15)21(16)18;1-13-6-9-19-17(10-13)12-16-8-7-15-11-14-4-2-3-5-18(14)20(15)21(16)19;1-13-6-7-15-12-17-9-8-16-11-14-4-2-3-5-18(14)20(16)21(17)19(15)10-13;1-21-17-9-5-4-8-16(17)20-18(21)11-10-14-12-13-6-2-3-7-15(13)19(14)20/h2-8,11-12H,9-10H2,1H3;4*2-10H,11-12H2,1H3;2-11H,12H2,1H3.

What are the key properties of 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?

9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene has a molecular weight of 1611.14 g/mol, XLogP of 30.59, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 9-methyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;6-methyl-10,12-dihydroindeno[2,1-b]fluorene;4-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;7-methylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is sourced from PubChem (CID 160764659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).