2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline

C209H184BrN11O2 — CID 159942973

IUPAC2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline
SMILESCCN(CC)c1ccc(C=Cc2ccc3c(C#N)c(C=Cc4ccc(N(CC)CC)cc4)ccc3c2)cc1.COc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(OC)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(C)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccccc2)c2ccc(C=Cc3ccc4c(Br)c(C=Cc5ccc(N(c6ccccc6)c6ccc(C)cc6)cc5)ccc4c3)cc2)cc1
InChIInChI=1S/C61H53N3O2.C61H53N3.C52H41BrN2.C35H37N3/c1-65-54-36-32-52(33-37-54)63(60-15-7-11-46-9-3-5-13-57(46)60)50-28-20-43(21-29-50)17-18-45-24-40-56-49(41-45)27-26-48(59(56)42-62)25-19-44-22-30-51(31-23-44)64(53-34-38-55(66-2)39-35-53)61-16-8-12-47-10-4-6-14-58(47)61;1-43-17-32-52(33-18-43)63(60-15-7-11-48-9-3-5-13-57(48)60)54-36-24-45(25-37-54)21-22-47-28-40-56-51(41-47)31-30-50(59(56)42-62)29-23-46-26-38-55(39-27-46)64(53-34-19-44(2)20-35-53)61-16-8-12-49-10-4-6-14-58(49)61;1-38-13-28-47(29-14-38)54(45-9-5-3-6-10-45)49-32-20-40(21-33-49)17-18-42-24-36-51-44(37-42)27-26-43(52(51)53)25-19-41-22-34-50(35-23-41)55(46-11-7-4-8-12-46)48-30-15-39(2)16-31-48;1-5-37(6-2)32-20-12-27(13-21-32)9-10-29-16-24-34-31(25-29)19-18-30(35(34)26-36)17-11-28-14-22-33(23-15-28)38(7-3)8-4/h7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;3-37H,1-2H3;9-25H,5-8H2,1-4H3
InChIKeyOBCXFTDGQWEFDN-UHFFFAOYSA-N
MW2961.75 g/mol
LogP56.38
Rot. Bonds42

About 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline

2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline (PubChem CID 159942973) has the molecular formula C209H184BrN11O2 and a molecular weight of 2961.75 g/mol. Its IUPAC name is 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline.

Molecular Properties

Compound Name2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline
PubChem CID159942973
Molecular FormulaC209H184BrN11O2
Molecular Weight2961.75 g/mol
Exact Mass2958.38
IUPAC Name2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline
SMILESCCN(CC)c1ccc(C=Cc2ccc3c(C#N)c(C=Cc4ccc(N(CC)CC)cc4)ccc3c2)cc1.COc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(OC)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(C)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccccc2)c2ccc(C=Cc3ccc4c(Br)c(C=Cc5ccc(N(c6ccccc6)c6ccc(C)cc6)cc5)ccc4c3)cc2)cc1
InChIInChI=1S/C61H53N3O2.C61H53N3.C52H41BrN2.C35H37N3/c1-65-54-36-32-52(33-37-54)63(60-15-7-11-46-9-3-5-13-57(46)60)50-28-20-43(21-29-50)17-18-45-24-40-56-49(41-45)27-26-48(59(56)42-62)25-19-44-22-30-51(31-23-44)64(53-34-38-55(66-2)39-35-53)61-16-8-12-47-10-4-6-14-58(47)61;1-43-17-32-52(33-18-43)63(60-15-7-11-48-9-3-5-13-57(48)60)54-36-24-45(25-37-54)21-22-47-28-40-56-51(41-47)31-30-50(59(56)42-62)29-23-46-26-38-55(39-27-46)64(53-34-19-44(2)20-35-53)61-16-8-12-49-10-4-6-14-58(49)61;1-38-13-28-47(29-14-38)54(45-9-5-3-6-10-45)49-32-20-40(21-33-49)17-18-42-24-36-51-44(37-42)27-26-43(52(51)53)25-19-41-22-34-50(35-23-41)55(46-11-7-4-8-12-46)48-30-15-39(2)16-31-48;1-5-37(6-2)32-20-12-27(13-21-32)9-10-29-16-24-34-31(25-29)19-18-30(35(34)26-36)17-11-28-14-22-33(23-15-28)38(7-3)8-4/h7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;3-37H,1-2H3;9-25H,5-8H2,1-4H3
InChIKeyOBCXFTDGQWEFDN-UHFFFAOYSA-N
XLogP56.38
TPSA115.75 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds42
Heavy Atoms223
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002961.75
LogP ≤ 556.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline with MolForge

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Related Compounds

2,6-bis[(E)-2-[4-(4-methoxy-N-naphthalen-1-ylanilino)phenyl]ethenyl]naphthalene-1-carbonitrile
CID 18338876
3-[2-[4-(diethylamino)phenyl]ethenyl]anthracene-9-carbonitrile;3-[2-[4-(dinaphthalen-1-ylamino)phenyl]ethenyl]anthracene-9-carbonitrile;3-[2-[4-[N-naphthalen-1-yl-4-(trifluoromethyl)anilino]phenyl]ethenyl]anthracene-9-carbonitrile;3-[2-[4-[N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]anthracene-9-carbonitrile
CID 159205136
N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline
CID 59923887
2,6-bis[(E)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]naphthalene-1,5-dicarbonitrile
CID 11297254
N-[4-[2-(4-methylphenyl)ethenyl]phenyl]-N-[4-(2-phenylethenyl)phenyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 54210687
2-[2-[4-(N-[4-(hydroxymethyl)phenyl]anilino)phenyl]ethenyl]-6-[2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]naphthalene-1,5-dicarbonitrile
CID 77422928
2,6-bis[(E)-2-[4-(4-methoxy-N-naphthalen-1-ylanilino)phenyl]ethenyl]anthracene-9-carbonitrile
CID 23576507
5-isocyano-6-[2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]-2-methylnaphthalene-1-carbonitrile
CID 59751569
N-[4-[(Z)-2-[6-[(Z)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]anthracen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline
CID 59905387
2,6-bis[2-[4-(4-methoxy-N-naphthalen-1-ylanilino)phenyl]ethenyl]anthracene-9,10-dicarbonitrile
CID 89372318
5-isocyano-2,6-bis[(E)-2-[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]ethenyl]naphthalene-1-carbonitrile
CID 18338881
2,6-bis[(E)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]anthracene-9-carbonitrile
CID 23576500

Frequently Asked Questions

What is the IUPAC name of 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline?
The IUPAC name of 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline (CID 159942973) is 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline.
What is the SMILES notation for 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline?
The canonical SMILES for 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline is CCN(CC)c1ccc(C=Cc2ccc3c(C#N)c(C=Cc4ccc(N(CC)CC)cc4)ccc3c2)cc1.COc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(OC)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccc(C=Cc3ccc4c(C#N)c(C=Cc5ccc(N(c6ccc(C)cc6)c6cccc7c6CCCC7)cc5)ccc4c3)cc2)c2cccc3c2CCCC3)cc1.Cc1ccc(N(c2ccccc2)c2ccc(C=Cc3ccc4c(Br)c(C=Cc5ccc(N(c6ccccc6)c6ccc(C)cc6)cc5)ccc4c3)cc2)cc1.
What is the InChIKey of 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline?
The InChIKey is OBCXFTDGQWEFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H53N3O2.C61H53N3.C52H41BrN2.C35H37N3/c1-65-54-36-32-52(33-37-54)63(60-15-7-11-46-9-3-5-13-57(46)60)50-28-20-43(21-29-50)17-18-45-24-40-56-49(41-45)27-26-48(59(56)42-62)25-19-44-22-30-51(31-23-44)64(53-34-38-55(66-2)39-35-53)61-16-8-12-47-10-4-6-14-58(47)61;1-43-17-32-52(33-18-43)63(60-15-7-11-48-9-3-5-13-57(48)60)54-36-24-45(25-37-54)21-22-47-28-40-56-51(41-47)31-30-50(59(56)42-62)29-23-46-26-38-55(39-27-46)64(53-34-19-44(2)20-35-53)61-16-8-12-49-10-4-6-14-58(49)61;1-38-13-28-47(29-14-38)54(45-9-5-3-6-10-45)49-32-20-40(21-33-49)17-18-42-24-36-51-44(37-42)27-26-43(52(51)53)25-19-41-22-34-50(35-23-41)55(46-11-7-4-8-12-46)48-30-15-39(2)16-31-48;1-5-37(6-2)32-20-12-27(13-21-32)9-10-29-16-24-34-31(25-29)19-18-30(35(34)26-36)17-11-28-14-22-33(23-15-28)38(7-3)8-4/h7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;7-8,11-12,15-41H,3-6,9-10,13-14H2,1-2H3;3-37H,1-2H3;9-25H,5-8H2,1-4H3.
What are the key properties of 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline?
2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline has a molecular weight of 2961.75 g/mol, XLogP of 56.38, 42 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[2-[4-(diethylamino)phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;2,6-bis[2-[4-[4-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)anilino]phenyl]ethenyl]naphthalene-1-carbonitrile;N-[4-[2-[5-bromo-6-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-4-methyl-N-phenylaniline is sourced from PubChem (CID 159942973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).