methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene

C129H105N7 — CID 159953669

About methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene

methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene (PubChem CID 159953669) has the molecular formula C129H105N7 and a molecular weight of 1753.31 g/mol. Its IUPAC name is methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene.

Molecular Properties

• Compound Name: methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene
• PubChem CID: 159953669
• Molecular Formula: C129H105N7
• Molecular Weight: 1753.31 g/mol
• Exact Mass: 1751.84
• IUPAC Name: methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene
• SMILES: C.C.C.C.Cc1c2ccccc2cc2c3c(cnc12)Cc1ccccc1-3.Cc1cc2c3c(cnc2c2ncccc12)Cc1ccccc1-3.Cc1ccc2ccc3c4c(cnc3c2n1)Cc1ccccc1-4.Cc1cccc2c1Cc1ccc3cc4ccccc4cc3c1-2.Cc1ccnc2c1Cc1ccc3cc4ccccc4cc3c1-2.Cc1nc2cc3ccccc3cc2c2c1Cc1ccccc1-2
• InChI: InChI=1S/C22H16.3C21H15N.2C20H14N2.4CH4/c1-14-5-4-8-19-20(14)13-18-10-9-17-11-15-6-2-3-7-16(15)12-21(17)22(18)19;1-13-17-8-4-2-7-15(17)11-19-20-16(12-22-21(13)19)10-14-6-3-5-9-18(14)20;1-13-18-11-16-8-4-5-9-17(16)21(18)19-10-14-6-2-3-7-15(14)12-20(19)22-13;1-13-8-9-22-21-18(13)12-17-7-6-16-10-14-4-2-3-5-15(14)11-19(16)20(17)21;1-12-9-17-18-14(10-13-5-2-3-6-16(13)18)11-22-20(17)19-15(12)7-4-8-21-19;1-12-6-7-13-8-9-17-18-15(11-21-20(17)19(13)22-12)10-14-4-2-3-5-16(14)18;;;;/h2-12H,13H2,1H3;2-9,11-12H,10H2,1H3;2-10,12H,11H2,1H3;2-11H,12H2,1H3;2*2-9,11H,10H2,1H3;4*1H4
• InChIKey: OCKZZICPOISQLE-UHFFFAOYSA-N
• XLogP: 33.55
• TPSA: 90.23 Ų
• H-Bond Acceptors: 7
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1753.31
LogP ≤ 5	33.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene?

The IUPAC name of methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene (CID 159953669) is methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene.

What is the SMILES notation for methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene?

The canonical SMILES for methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene is C.C.C.C.Cc1c2ccccc2cc2c3c(cnc12)Cc1ccccc1-3.Cc1cc2c3c(cnc2c2ncccc12)Cc1ccccc1-3.Cc1ccc2ccc3c4c(cnc3c2n1)Cc1ccccc1-4.Cc1cccc2c1Cc1ccc3cc4ccccc4cc3c1-2.Cc1ccnc2c1Cc1ccc3cc4ccccc4cc3c1-2.Cc1nc2cc3ccccc3cc2c2c1Cc1ccccc1-2.

What is the InChIKey of methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene?

The InChIKey is OCKZZICPOISQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16.3C21H15N.2C20H14N2.4CH4/c1-14-5-4-8-19-20(14)13-18-10-9-17-11-15-6-2-3-7-16(15)12-21(17)22(18)19;1-13-17-8-4-2-7-15(17)11-19-20-16(12-22-21(13)19)10-14-6-3-5-9-18(14)20;1-13-18-11-16-8-4-5-9-17(16)21(18)19-10-14-6-2-3-7-15(14)12-20(19)22-13;1-13-8-9-22-21-18(13)12-17-7-6-16-10-14-4-2-3-5-15(14)11-19(16)20(17)21;1-12-9-17-18-14(10-13-5-2-3-6-16(13)18)11-22-20(17)19-15(12)7-4-8-21-19;1-12-6-7-13-8-9-17-18-15(11-21-20(17)19(13)22-12)10-14-4-2-3-5-16(14)18;;;;/h2-12H,13H2,1H3;2-9,11-12H,10H2,1H3;2-10,12H,11H2,1H3;2-11H,12H2,1H3;2*2-9,11H,10H2,1H3;4*1H4.

What are the key properties of methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene?

methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene has a molecular weight of 1753.31 g/mol, XLogP of 33.55, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for methane;7-methyl-4-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;11-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;14-methyl-12-azapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),2(10),3,5,7,11,13,15,17,19-decaene;16-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;20-methyl-12,15-diazapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1,3,5,7,10,12,14(19),15,17,20-decaene;9-methyl-8H-indeno[1,2-a]anthracene is sourced from PubChem (CID 159953669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).