(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine

C100H128N16O8 — CID 157260568

IUPAC(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine
SMILESCc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1/CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N\OCO/N=C1\CCCc2c1nc(C)c(C)c2C
InChIInChI=1S/4C25H32N4O2/c4*1-14-16(3)20-9-7-11-22(24(20)26-18(14)5)28-30-13-31-29-23-12-8-10-21-17(4)15(2)19(6)27-25(21)23/h4*7-13H2,1-6H3/b28-22+,29-23+;2*28-22-,29-23+;28-22-,29-23-
InChIKeyAXKCYBRMKFZSCY-UFCOVAMQSA-N
MW1682.23 g/mol
LogP20.40
Rot. Bonds16

About (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine

(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine (PubChem CID 157260568) has the molecular formula C100H128N16O8 and a molecular weight of 1682.23 g/mol. Its IUPAC name is (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine.

Molecular Properties

Compound Name(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine
PubChem CID157260568
Molecular FormulaC100H128N16O8
Molecular Weight1682.23 g/mol
Exact Mass1681.01
IUPAC Name(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine
SMILESCc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1/CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N\OCO/N=C1\CCCc2c1nc(C)c(C)c2C
InChIInChI=1S/4C25H32N4O2/c4*1-14-16(3)20-9-7-11-22(24(20)26-18(14)5)28-30-13-31-29-23-12-8-10-21-17(4)15(2)19(6)27-25(21)23/h4*7-13H2,1-6H3/b28-22+,29-23+;2*28-22-,29-23+;28-22-,29-23-
InChIKeyAXKCYBRMKFZSCY-UFCOVAMQSA-N
XLogP20.40
TPSA275.84 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds16
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001682.23
LogP ≤ 520.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine with MolForge

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Frequently Asked Questions

What is the IUPAC name of (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine?
The IUPAC name of (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine (CID 157260568) is (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine.
What is the SMILES notation for (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine?
The canonical SMILES for (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine is Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1/CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N/OCO/N=C1\CCCc2c1nc(C)c(C)c2C.Cc1nc2c(c(C)c1C)CCC/C2=N\OCO/N=C1\CCCc2c1nc(C)c(C)c2C.
What is the InChIKey of (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine?
The InChIKey is AXKCYBRMKFZSCY-UFCOVAMQSA-N. The full InChI is InChI=1S/4C25H32N4O2/c4*1-14-16(3)20-9-7-11-22(24(20)26-18(14)5)28-30-13-31-29-23-12-8-10-21-17(4)15(2)19(6)27-25(21)23/h4*7-13H2,1-6H3/b28-22+,29-23+;2*28-22-,29-23+;28-22-,29-23-.
What are the key properties of (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine?
(Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine has a molecular weight of 1682.23 g/mol, XLogP of 20.40, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,3,4-trimethyl-N-[[(Z)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine;bis((Z)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine);(E)-2,3,4-trimethyl-N-[[(E)-(2,3,4-trimethyl-6,7-dihydro-5H-quinolin-8-ylidene)amino]oxymethoxy]-6,7-dihydro-5H-quinolin-8-imine is sourced from PubChem (CID 157260568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).