3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene

C104H110N14 — CID 161287403

IUPAC3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
SMILESCc1cc(C)c2c(n1)Cc1ncc(C)c(C)c1-2.Cc1cc2c(nc1C)Cc1ncc(C)c(C)c1-2.Cc1ccc2c(n1)Cc1nc(C)c(C)c(C)c1-2.Cc1ccc2c(n1)Cc1ncc(C)c(C)c1-2.Cc1ccnc2c1-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1)-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1C)-c1c(ncc(C)c1C)C2
InChIInChI=1S/6C15H16N2.C14H14N2/c1-8-6-16-12-5-13-15(14(12)10(8)3)11(4)9(2)7-17-13;1-8-5-12-13(17-11(8)4)6-14-15(12)10(3)9(2)7-16-14;1-8-5-10(3)17-13-6-12-15(14(8)13)11(4)9(2)7-16-12;1-8-5-12-13(16-7-8)6-14-15(12)10(3)9(2)11(4)17-14;1-8-5-6-16-12-7-13-15(14(8)12)10(3)9(2)11(4)17-13;1-8-5-6-12-13(16-8)7-14-15(12)10(3)9(2)11(4)17-14;1-8-7-15-13-6-12-11(14(13)10(8)3)5-4-9(2)16-12/h6-7H,5H2,1-4H3;3*5,7H,6H2,1-4H3;2*5-6H,7H2,1-4H3;4-5,7H,6H2,1-3H3
InChIKeyVFXATCVUDPXRBH-UHFFFAOYSA-N
MW1556.12 g/mol
LogP22.66
Rot. Bonds

About 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene

3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene (PubChem CID 161287403) has the molecular formula C104H110N14 and a molecular weight of 1556.12 g/mol. Its IUPAC name is 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene.

Molecular Properties

Compound Name3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
PubChem CID161287403
Molecular FormulaC104H110N14
Molecular Weight1556.12 g/mol
Exact Mass1554.90
IUPAC Name3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
SMILESCc1cc(C)c2c(n1)Cc1ncc(C)c(C)c1-2.Cc1cc2c(nc1C)Cc1ncc(C)c(C)c1-2.Cc1ccc2c(n1)Cc1nc(C)c(C)c(C)c1-2.Cc1ccc2c(n1)Cc1ncc(C)c(C)c1-2.Cc1ccnc2c1-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1)-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1C)-c1c(ncc(C)c1C)C2
InChIInChI=1S/6C15H16N2.C14H14N2/c1-8-6-16-12-5-13-15(14(12)10(8)3)11(4)9(2)7-17-13;1-8-5-12-13(17-11(8)4)6-14-15(12)10(3)9(2)7-16-14;1-8-5-10(3)17-13-6-12-15(14(8)13)11(4)9(2)7-16-12;1-8-5-12-13(16-7-8)6-14-15(12)10(3)9(2)11(4)17-14;1-8-5-6-16-12-7-13-15(14(8)12)10(3)9(2)11(4)17-13;1-8-5-6-12-13(16-8)7-14-15(12)10(3)9(2)11(4)17-14;1-8-7-15-13-6-12-11(14(13)10(8)3)5-4-9(2)16-12/h6-7H,5H2,1-4H3;3*5,7H,6H2,1-4H3;2*5-6H,7H2,1-4H3;4-5,7H,6H2,1-3H3
InChIKeyVFXATCVUDPXRBH-UHFFFAOYSA-N
XLogP22.66
TPSA180.46 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds
Heavy Atoms118
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001556.12
LogP ≤ 522.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene?
The IUPAC name of 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene (CID 161287403) is 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene.
What is the SMILES notation for 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene?
The canonical SMILES for 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene is Cc1cc(C)c2c(n1)Cc1ncc(C)c(C)c1-2.Cc1cc2c(nc1C)Cc1ncc(C)c(C)c1-2.Cc1ccc2c(n1)Cc1nc(C)c(C)c(C)c1-2.Cc1ccc2c(n1)Cc1ncc(C)c(C)c1-2.Cc1ccnc2c1-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1)-c1c(nc(C)c(C)c1C)C2.Cc1cnc2c(c1C)-c1c(ncc(C)c1C)C2.
What is the InChIKey of 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene?
The InChIKey is VFXATCVUDPXRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/6C15H16N2.C14H14N2/c1-8-6-16-12-5-13-15(14(12)10(8)3)11(4)9(2)7-17-13;1-8-5-12-13(17-11(8)4)6-14-15(12)10(3)9(2)7-16-14;1-8-5-10(3)17-13-6-12-15(14(8)13)11(4)9(2)7-16-12;1-8-5-12-13(16-7-8)6-14-15(12)10(3)9(2)11(4)17-14;1-8-5-6-16-12-7-13-15(14(8)12)10(3)9(2)11(4)17-13;1-8-5-6-12-13(16-8)7-14-15(12)10(3)9(2)11(4)17-14;1-8-7-15-13-6-12-11(14(13)10(8)3)5-4-9(2)16-12/h6-7H,5H2,1-4H3;3*5,7H,6H2,1-4H3;2*5-6H,7H2,1-4H3;4-5,7H,6H2,1-3H3.
What are the key properties of 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene?
3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene has a molecular weight of 1556.12 g/mol, XLogP of 22.66, 0 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,11-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;3,4,5,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;3,4,11,12-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,11,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;3,4,12,13-tetramethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene;3,4,11-trimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene is sourced from PubChem (CID 161287403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).