14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene

C158H100N8 — CID 159541677

About 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene

14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene (PubChem CID 159541677) has the molecular formula C158H100N8 and a molecular weight of 2110.59 g/mol. Its IUPAC name is 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene.

Molecular Properties

• Compound Name: 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene
• PubChem CID: 159541677
• Molecular Formula: C158H100N8
• Molecular Weight: 2110.59 g/mol
• Exact Mass: 2108.81
• IUPAC Name: 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene
• SMILES: c1ccc(-c2cccc(-n3c4ccc5ccccc5c4c4c5ccccc5c5c(c6ccccc6n5-c5ccc6ccccc6c5)c43)c2)cc1.c1ccc(-n2c3cc4c(cc3c3c5ccccc5ccc32)c2c3ccccc3ccc2n4-c2ccccc2)cc1.c1ccc(-n2c3cc4c(cc3c3c5ccccc5ccc32)c2ccc3ccccc3c2n4-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3c4c5c6ccccc6ccc5n(-c5ccccc5)c4ccc32)cc1
• InChI: InChI=1S/C48H30N2.2C38H24N2.C34H22N2/c1-2-13-31(14-3-1)35-18-12-19-36(29-35)50-43-28-26-33-16-6-7-20-38(33)44(43)45-39-21-8-9-22-40(39)47-46(48(45)50)41-23-10-11-24-42(41)49(47)37-27-25-32-15-4-5-17-34(32)30-37;1-3-13-27(14-4-1)39-34-22-20-25-11-7-9-17-29(25)37(34)33-23-32-31-21-19-26-12-8-10-18-30(26)38(31)40(35(32)24-36(33)39)28-15-5-2-6-16-28;1-3-13-27(14-4-1)39-33-21-19-25-11-7-9-17-29(25)37(33)31-23-32-36(24-35(31)39)40(28-15-5-2-6-16-28)34-22-20-26-12-8-10-18-30(26)38(32)34;1-3-12-24(13-4-1)35-28-18-10-9-17-27(28)33-30(35)21-22-31-34(33)32-26-16-8-7-11-23(26)19-20-29(32)36(31)25-14-5-2-6-15-25/h1-30H;2*1-24H;1-22H
• InChIKey: MEHFDRPYMODZCA-UHFFFAOYSA-N
• XLogP: 42.42
• TPSA: 39.44 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 9
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2110.59
LogP ≤ 5	42.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene?

The IUPAC name of 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene (CID 159541677) is 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene.

What is the SMILES notation for 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene?

The canonical SMILES for 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene is c1ccc(-c2cccc(-n3c4ccc5ccccc5c4c4c5ccccc5c5c(c6ccccc6n5-c5ccc6ccccc6c5)c43)c2)cc1.c1ccc(-n2c3cc4c(cc3c3c5ccccc5ccc32)c2c3ccccc3ccc2n4-c2ccccc2)cc1.c1ccc(-n2c3cc4c(cc3c3c5ccccc5ccc32)c2ccc3ccccc3c2n4-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3c4c5c6ccccc6ccc5n(-c5ccccc5)c4ccc32)cc1.

What is the InChIKey of 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene?

The InChIKey is MEHFDRPYMODZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2.2C38H24N2.C34H22N2/c1-2-13-31(14-3-1)35-18-12-19-36(29-35)50-43-28-26-33-16-6-7-20-38(33)44(43)45-39-21-8-9-22-40(39)47-46(48(45)50)41-23-10-11-24-42(41)49(47)37-27-25-32-15-4-5-17-34(32)30-37;1-3-13-27(14-4-1)39-34-22-20-25-11-7-9-17-29(25)37(34)33-23-32-31-21-19-26-12-8-10-18-30(26)38(31)40(35(32)24-36(33)39)28-15-5-2-6-16-28;1-3-13-27(14-4-1)39-33-21-19-25-11-7-9-17-29(25)37(33)31-23-32-36(24-35(31)39)40(28-15-5-2-6-16-28)34-22-20-26-12-8-10-18-30(26)38(32)34;1-3-12-24(13-4-1)35-28-18-10-9-17-27(28)33-30(35)21-22-31-34(33)32-26-16-8-7-11-23(26)19-20-29(32)36(31)25-14-5-2-6-15-25/h1-30H;2*1-24H;1-22H.

What are the key properties of 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene?

14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene has a molecular weight of 2110.59 g/mol, XLogP of 42.42, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.020,25]octacosa-1,3(15),4(13),5,7,9,11,16,19(28),20,22,24,26-tridecaene;14,18-diphenyl-14,18-diazaheptacyclo[15.11.0.03,15.04,13.05,10.019,28.022,27]octacosa-1(17),2,4(13),5,7,9,11,15,19(28),20,22,24,26-tridecaene;9,14-diphenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;9-naphthalen-2-yl-28-(3-phenylphenyl)-9,28-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene is sourced from PubChem (CID 159541677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).