10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine

C70H52N4 — CID 159832144

About 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine

10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine (PubChem CID 159832144) has the molecular formula C70H52N4 and a molecular weight of 949.21 g/mol. Its IUPAC name is 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine.

Molecular Properties

• Compound Name: 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine
• PubChem CID: 159832144
• Molecular Formula: C70H52N4
• Molecular Weight: 949.21 g/mol
• Exact Mass: 948.42
• IUPAC Name: 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine
• SMILES: Cc1ccc(N(C2=C3c4cccc5c6c(-c7ccccc7)c7c(c(-c8ccccc8)c6n(c45)C3CC=C2)c2cccc3c4c(N(c5ccccc5)c5ccc(C)c(C)c5)cccc4n7c32)c2ccccc2)cc1C
• InChI: InChI=1S/C70H52N4/c1-43-37-39-51(41-45(43)3)71(49-25-13-7-14-26-49)57-33-19-35-59-63(57)53-29-17-31-55-65-62(48-23-11-6-12-24-48)70-66(61(47-21-9-5-10-22-47)69(65)73(59)67(53)55)56-32-18-30-54-64-58(34-20-36-60(64)74(70)68(54)56)72(50-27-15-8-16-28-50)52-40-38-44(2)46(4)42-52/h5-35,37-42,60H,36H2,1-4H3
• InChIKey: NNPASJMLZBKJSC-UHFFFAOYSA-N
• XLogP: 19.05
• TPSA: 15.82 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	949.21
LogP ≤ 5	19.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine?

The IUPAC name of 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine (CID 159832144) is 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine.

What is the SMILES notation for 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine?

The canonical SMILES for 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine is Cc1ccc(N(C2=C3c4cccc5c6c(-c7ccccc7)c7c(c(-c8ccccc8)c6n(c45)C3CC=C2)c2cccc3c4c(N(c5ccccc5)c5ccc(C)c(C)c5)cccc4n7c32)c2ccccc2)cc1C.

What is the InChIKey of 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine?

The InChIKey is NNPASJMLZBKJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H52N4/c1-43-37-39-51(41-45(43)3)71(49-25-13-7-14-26-49)57-33-19-35-59-63(57)53-29-17-31-55-65-62(48-23-11-6-12-24-48)70-66(61(47-21-9-5-10-22-47)69(65)73(59)67(53)55)56-32-18-30-54-64-58(34-20-36-60(64)74(70)68(54)56)72(50-27-15-8-16-28-50)52-40-38-44(2)46(4)42-52/h5-35,37-42,60H,36H2,1-4H3.

What are the key properties of 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine?

10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine has a molecular weight of 949.21 g/mol, XLogP of 19.05, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 10-N,25-N-bis(3,4-dimethylphenyl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(31),2(19),3,6(11),7,9,12(32),13,15,17,23,25,27,29-tetradecaene-10,25-diamine is sourced from PubChem (CID 159832144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).