1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol

C139H144N18O6 — CID 172936208

About 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol

1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol (PubChem CID 172936208) has the molecular formula C139H144N18O6 and a molecular weight of 2162.80 g/mol. Its IUPAC name is 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol.

Molecular Properties

• Compound Name: 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol
• PubChem CID: 172936208
• Molecular Formula: C139H144N18O6
• Molecular Weight: 2162.80 g/mol
• Exact Mass: 2161.15
• IUPAC Name: 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol
• SMILES: CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc(N(C)C)cc2)c2ccccc2)c1.CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc2)c1.CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc3c(c2)c2ccccc2n3CC)c2ccccc2)c1
• InChI: InChI=1S/C51H50N6O2.C47H48N6O2.C41H46N6O2/c1-3-54(4-2)49-35-32-42(38-53-57(47-26-16-8-17-27-47)48-28-18-9-19-29-48)51(36-49)59-40-50(58)39-55(43-20-10-5-11-21-43)52-37-41-30-33-46(34-31-41)56(44-22-12-6-13-23-44)45-24-14-7-15-25-45;1-4-50(5-2)41-28-27-37(33-49-53(39-20-12-8-13-21-39)40-22-14-9-15-23-40)47(31-41)55-35-42(54)34-52(38-18-10-7-11-19-38)48-32-36-26-29-46-44(30-36)43-24-16-17-25-45(43)51(46)6-3;1-5-45(6-2)39-27-24-34(30-43-47(37-18-12-8-13-19-37)38-20-14-9-15-21-38)41(28-39)49-32-40(48)31-46(36-16-10-7-11-17-36)42-29-33-22-25-35(26-23-33)44(3)4/h5-38,50,58H,3-4,39-40H2,1-2H3;7-33,42,54H,4-6,34-35H2,1-3H3;7-30,40,48H,5-6,31-32H2,1-4H3/b52-37+,53-38+;48-32+,49-33+;42-29+,43-30+
• InChIKey: QTWADQTXRSNQBQ-NCDRAHGDSA-N
• XLogP: 29.62
• TPSA: 203.11 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 24
• Rotatable Bonds: 50
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2162.80
LogP ≤ 5	29.62
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hzone_anil_di_alk(35)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol?

The IUPAC name of 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol (CID 172936208) is 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol.

What is the SMILES notation for 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol?

The canonical SMILES for 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol is CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc(N(C)C)cc2)c2ccccc2)c1.CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc2)c1.CCN(CC)c1ccc(/C=N/N(c2ccccc2)c2ccccc2)c(OCC(O)CN(/N=C/c2ccc3c(c2)c2ccccc2n3CC)c2ccccc2)c1.

What is the InChIKey of 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol?

The InChIKey is QTWADQTXRSNQBQ-NCDRAHGDSA-N. The full InChI is InChI=1S/C51H50N6O2.C47H48N6O2.C41H46N6O2/c1-3-54(4-2)49-35-32-42(38-53-57(47-26-16-8-17-27-47)48-28-18-9-19-29-48)51(36-49)59-40-50(58)39-55(43-20-10-5-11-21-43)52-37-41-30-33-46(34-31-41)56(44-22-12-6-13-23-44)45-24-14-7-15-25-45;1-4-50(5-2)41-28-27-37(33-49-53(39-20-12-8-13-21-39)40-22-14-9-15-23-40)47(31-41)55-35-42(54)34-52(38-18-10-7-11-19-38)48-32-36-26-29-46-44(30-36)43-24-16-17-25-45(43)51(46)6-3;1-5-45(6-2)39-27-24-34(30-43-47(37-18-12-8-13-19-37)38-20-14-9-15-21-38)41(28-39)49-32-40(48)31-46(36-16-10-7-11-17-36)42-29-33-22-25-35(26-23-33)44(3)4/h5-38,50,58H,3-4,39-40H2,1-2H3;7-33,42,54H,4-6,34-35H2,1-3H3;7-30,40,48H,5-6,31-32H2,1-4H3/b52-37+,53-38+;48-32+,49-33+;42-29+,43-30+.

What are the key properties of 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol?

1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol has a molecular weight of 2162.80 g/mol, XLogP of 29.62, 50 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]anilino)propan-2-ol;1-[5-(diethylamino)-2-[(E)-(diphenylhydrazinylidene)methyl]phenoxy]-3-(N-[(E)-[4-(N-phenylanilino)phenyl]methylideneamino]anilino)propan-2-ol is sourced from PubChem (CID 172936208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).