1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane

C176H220N4 — CID 167594133

About 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane

1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane (PubChem CID 167594133) has the molecular formula C176H220N4 and a molecular weight of 2391.72 g/mol. Its IUPAC name is 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane.

Molecular Properties

• Compound Name: 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane
• PubChem CID: 167594133
• Molecular Formula: C176H220N4
• Molecular Weight: 2391.72 g/mol
• Exact Mass: 2389.73
• IUPAC Name: 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane
• SMILES: C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4c5c(ccc4n-3c12)Cc1ccccc1-5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4cc5c(cc4n-3c12)-c1ccccc1C5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4cc5c(cc4n-3c12)Cc1ccccc1-5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4ccc5c(c4n-3c12)-c1ccccc1C5
• InChI: InChI=1S/4C33H21N.20C2H6.4CH4/c1-3-9-25-20(7-1)13-23-17-31-24(16-28(23)25)14-21-8-5-11-27-30-15-22-12-19-6-2-4-10-26(19)29(22)18-32(30)34(31)33(21)27;1-3-9-25-19(6-1)12-22-16-31-24(15-28(22)25)14-21-8-5-11-27-30-18-29-23(17-32(30)34(31)33(21)27)13-20-7-2-4-10-26(20)29;1-3-9-25-19(6-1)15-23-18-30-24(17-28(23)25)16-22-8-5-11-27-32-29(34(30)33(22)27)13-12-21-14-20-7-2-4-10-26(20)31(21)32;1-3-9-25-19(6-1)15-23-18-30-24(17-29(23)25)16-22-8-5-11-27-28-13-12-21-14-20-7-2-4-10-26(20)31(21)33(28)34(30)32(22)27;20*1-2;;;;/h2*1-11,15-18H,12-14H2;2*1-13,17-18H,14-16H2;20*1-2H3;4*1H4
• InChIKey: IVCGOADFDJFSOC-UHFFFAOYSA-N
• XLogP: 54.39
• TPSA: 19.72 Ų
• H-Bond Acceptors: 4
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2391.72
LogP ≤ 5	54.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane?

The IUPAC name of 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane (CID 167594133) is 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane.

What is the SMILES notation for 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane?

The canonical SMILES for 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane is C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4c5c(ccc4n-3c12)Cc1ccccc1-5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4cc5c(cc4n-3c12)-c1ccccc1C5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4cc5c(cc4n-3c12)Cc1ccccc1-5.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1cccc2c4ccc5c(c4n-3c12)-c1ccccc1C5.

What is the InChIKey of 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane?

The InChIKey is IVCGOADFDJFSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/4C33H21N.20C2H6.4CH4/c1-3-9-25-20(7-1)13-23-17-31-24(16-28(23)25)14-21-8-5-11-27-30-15-22-12-19-6-2-4-10-26(19)29(22)18-32(30)34(31)33(21)27;1-3-9-25-19(6-1)12-22-16-31-24(15-28(22)25)14-21-8-5-11-27-30-18-29-23(17-32(30)34(31)33(21)27)13-20-7-2-4-10-26(20)29;1-3-9-25-19(6-1)15-23-18-30-24(17-28(23)25)16-22-8-5-11-27-32-29(34(30)33(22)27)13-12-21-14-20-7-2-4-10-26(20)31(21)32;1-3-9-25-19(6-1)15-23-18-30-24(17-29(23)25)16-22-8-5-11-27-28-13-12-21-14-20-7-2-4-10-26(20)31(21)33(28)34(30)32(22)27;20*1-2;;;;/h2*1-11,15-18H,12-14H2;2*1-13,17-18H,14-16H2;20*1-2H3;4*1H4.

What are the key properties of 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane?

1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane has a molecular weight of 2391.72 g/mol, XLogP of 54.39, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-azanonacyclo[17.14.1.02,14.03,11.04,9.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3(11),4,6,8,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.05,10.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5,7,9,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.04,12.06,11.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,6,8,10,12,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;1-azanonacyclo[17.14.1.02,14.05,13.07,12.015,34.021,33.023,31.024,29]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(34),21,23(31),24,26,28,32-pentadecaene;ethane;methane is sourced from PubChem (CID 167594133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).