N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

C62H49N — CID 134320830

IUPACN-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESCC1C=Cc2cccc(C/C=C(\C=C/c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)c3)c2C1
InChIInChI=1S/C62H49N/c1-45-25-29-54-18-10-19-55(61(54)43-45)34-33-51(32-28-46-26-30-49(31-27-46)47-13-4-2-5-14-47)56-21-11-22-57(44-56)52-37-41-59(42-38-52)63(62-24-12-20-53-17-8-9-23-60(53)62)58-39-35-50(36-40-58)48-15-6-3-7-16-48/h2-33,35-42,44-45H,34,43H2,1H3/b32-28-,51-33+
InChIKeyHPFYOLGPGVZEKO-JDWSGZMSSA-N
MW808.08 g/mol
LogP16.86
Rot. Bonds11

About N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (PubChem CID 134320830) has the molecular formula C62H49N and a molecular weight of 808.08 g/mol. Its IUPAC name is N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
PubChem CID134320830
Molecular FormulaC62H49N
Molecular Weight808.08 g/mol
Exact Mass807.39
IUPAC NameN-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESCC1C=Cc2cccc(C/C=C(\C=C/c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)c3)c2C1
InChIInChI=1S/C62H49N/c1-45-25-29-54-18-10-19-55(61(54)43-45)34-33-51(32-28-46-26-30-49(31-27-46)47-13-4-2-5-14-47)56-21-11-22-57(44-56)52-37-41-59(42-38-52)63(62-24-12-20-53-17-8-9-23-60(53)62)58-39-35-50(36-40-58)48-15-6-3-7-16-48/h2-33,35-42,44-45H,34,43H2,1H3/b32-28-,51-33+
InChIKeyHPFYOLGPGVZEKO-JDWSGZMSSA-N
XLogP16.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500808.08
LogP ≤ 516.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine with MolForge

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Related Compounds

N-(3-methylphenyl)-N-[4-[4-[2-[4-[4-(N-phenylanilino)phenyl]phenyl]ethenyl]phenyl]phenyl]naphthalen-1-amine
CID 91284836
N-[4-[(Z)-2-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]ethenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 160623452
N-naphthalen-1-yl-N-[4-[2-[4-[4-(N-phenylanilino)phenyl]phenyl]ethenyl]phenyl]naphthalen-1-amine
CID 59575121
N,N-diphenyl-4-[2-[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethenyl]aniline;4-methyl-N-[4-[2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-[4-[2-[4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-phenylaniline;N-[4-[4-[N-naphthalen-1-yl-4-(2-phenylethenyl)anilino]phenyl]phenyl]-N-[4-(2-phenylethenyl)phenyl]naphthalen-1-amine
CID 161488206
N-naphthalen-1-yl-N-[4-[4-[(E)-2-[4-[4-[naphthalen-1-yl(naphthalen-2-yl)amino]phenyl]phenyl]ethenyl]phenyl]phenyl]naphthalen-2-amine
CID 58511479
N-(3,5-dimethylphenyl)-N-[4-[4-[(E)-2-[4-[4-(N-phenylanilino)phenyl]phenyl]ethenyl]phenyl]phenyl]naphthalen-1-amine
CID 89067967
N-[4-[4-[(E)-2-[4-[4-(4-tert-butyl-N-naphthalen-1-ylanilino)phenyl]phenyl]ethenyl]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-1-amine
CID 89068086
N-[4-[4-(N-naphthalen-1-yl-3-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-1-amine
CID 166859975
N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 59650467
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[4-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]phenyl]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 58612738
1,1'-biphenyl;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 172802336
N-[4-[3-[4-[N-naphthalen-1-yl-4-(2-phenylethenyl)anilino]phenyl]-1,4-diphenylnaphthalen-2-yl]phenyl]-N-[4-(2-phenylethenyl)phenyl]naphthalen-1-amine
CID 76601630

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The IUPAC name of N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (CID 134320830) is N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is CC1C=Cc2cccc(C/C=C(\C=C/c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5cccc6ccccc56)cc4)c3)c2C1.
What is the InChIKey of N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The InChIKey is HPFYOLGPGVZEKO-JDWSGZMSSA-N. The full InChI is InChI=1S/C62H49N/c1-45-25-29-54-18-10-19-55(61(54)43-45)34-33-51(32-28-46-26-30-49(31-27-46)47-13-4-2-5-14-47)56-21-11-22-57(44-56)52-37-41-59(42-38-52)63(62-24-12-20-53-17-8-9-23-60(53)62)58-39-35-50(36-40-58)48-15-6-3-7-16-48/h2-33,35-42,44-45H,34,43H2,1H3/b32-28-,51-33+.
What are the key properties of N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine has a molecular weight of 808.08 g/mol, XLogP of 16.86, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-[(1Z,3E)-5-(7-methyl-7,8-dihydronaphthalen-1-yl)-1-(4-phenylphenyl)penta-1,3-dien-3-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 134320830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).