10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine

C177H160N12OS — CID 159459010

About 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine

10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine (PubChem CID 159459010) has the molecular formula C177H160N12OS and a molecular weight of 2503.38 g/mol. Its IUPAC name is 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine.

Molecular Properties

• Compound Name: 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine
• PubChem CID: 159459010
• Molecular Formula: C177H160N12OS
• Molecular Weight: 2503.38 g/mol
• Exact Mass: 2501.26
• IUPAC Name: 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine
• SMILES: CN1c2ccc(N(c3ccccc3)c3ccccc3)cc2C(C)(C)c2cc(N(c3ccccc3)c3ccccc3)ccc21.CN1c2ccccc2C(C)(C)c2cc3c(cc21)C(C)(C)c1ccccc1-3.CN1c2ccccc2C(C)(C)c2cc3c(cc21)c1ccccc1n3-c1ccccc1.CN1c2ccccc2C(C)(C)c2ccc3c(c21)c1ccccc1n3-c1ccccc1.CN1c2ccccc2C(C)(C)c2ccccc21.CN1c2ccccc2Cc2ccccc21.CN1c2ccccc2Oc2ccccc21.CN1c2ccccc2Sc2ccccc21
• InChI: InChI=1S/C40H35N3.2C28H24N2.C25H25N.C16H17N.C14H13N.C13H11NO.C13H11NS/c1-40(2)36-28-34(42(30-16-8-4-9-17-30)31-18-10-5-11-19-31)24-26-38(36)41(3)39-27-25-35(29-37(39)40)43(32-20-12-6-13-21-32)33-22-14-7-15-23-33;1-28(2)22-14-8-10-16-25(22)29(3)27-17-21-20-13-7-9-15-24(20)30(26(21)18-23(27)28)19-11-5-4-6-12-19;1-28(2)21-14-8-10-16-24(21)29(3)27-22(28)17-18-25-26(27)20-13-7-9-15-23(20)30(25)19-11-5-4-6-12-19;1-24(2)18-11-7-6-10-16(18)17-14-21-23(15-20(17)24)26(5)22-13-9-8-12-19(22)25(21,3)4;1-16(2)12-8-4-6-10-14(12)17(3)15-11-7-5-9-13(15)16;1-15-13-8-4-2-6-11(13)10-12-7-3-5-9-14(12)15;2*1-14-10-6-2-4-8-12(10)15-13-9-5-3-7-11(13)14/h4-29H,1-3H3;2*4-18H,1-3H3;6-15H,1-5H3;4-11H,1-3H3;2-9H,10H2,1H3;2*2-9H,1H3
• InChIKey: LUIQWBIRXJHWMQ-UHFFFAOYSA-N
• XLogP: 46.75
• TPSA: 51.49 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 8
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2503.38
LogP ≤ 5	46.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het_thio_666_A(13)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine?

The IUPAC name of 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine (CID 159459010) is 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine.

What is the SMILES notation for 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine?

The canonical SMILES for 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine is CN1c2ccc(N(c3ccccc3)c3ccccc3)cc2C(C)(C)c2cc(N(c3ccccc3)c3ccccc3)ccc21.CN1c2ccccc2C(C)(C)c2cc3c(cc21)C(C)(C)c1ccccc1-3.CN1c2ccccc2C(C)(C)c2cc3c(cc21)c1ccccc1n3-c1ccccc1.CN1c2ccccc2C(C)(C)c2ccc3c(c21)c1ccccc1n3-c1ccccc1.CN1c2ccccc2C(C)(C)c2ccccc21.CN1c2ccccc2Cc2ccccc21.CN1c2ccccc2Oc2ccccc21.CN1c2ccccc2Sc2ccccc21.

What is the InChIKey of 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine?

The InChIKey is LUIQWBIRXJHWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H35N3.2C28H24N2.C25H25N.C16H17N.C14H13N.C13H11NO.C13H11NS/c1-40(2)36-28-34(42(30-16-8-4-9-17-30)31-18-10-5-11-19-31)24-26-38(36)41(3)39-27-25-35(29-37(39)40)43(32-20-12-6-13-21-32)33-22-14-7-15-23-33;1-28(2)22-14-8-10-16-25(22)29(3)27-17-21-20-13-7-9-15-24(20)30(26(21)18-23(27)28)19-11-5-4-6-12-19;1-28(2)21-14-8-10-16-24(21)29(3)27-22(28)17-18-25-26(27)20-13-7-9-15-23(20)30(25)19-11-5-4-6-12-19;1-24(2)18-11-7-6-10-16(18)17-14-21-23(15-20(17)24)26(5)22-13-9-8-12-19(22)25(21,3)4;1-16(2)12-8-4-6-10-14(12)17(3)15-11-7-5-9-13(15)16;1-15-13-8-4-2-6-11(13)10-12-7-3-5-9-14(12)15;2*1-14-10-6-2-4-8-12(10)15-13-9-5-3-7-11(13)14/h4-29H,1-3H3;2*4-18H,1-3H3;6-15H,1-5H3;4-11H,1-3H3;2-9H,10H2,1H3;2*2-9H,1H3.

What are the key properties of 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine?

10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine has a molecular weight of 2503.38 g/mol, XLogP of 46.75, 8 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 10-methyl-9H-acridine;10-methylphenothiazine;10-methylphenoxazine;10,10,14,21,21-pentamethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9,9,10-trimethylacridine;14,14,21-trimethyl-10-phenyl-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;8,8,13-trimethyl-5-phenylindolo[2,3-c]acridine;9,9,10-trimethyl-2-N,2-N,7-N,7-N-tetraphenylacridine-2,7-diamine is sourced from PubChem (CID 159459010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).