N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine

C56H38F6N2 — CID 162548483

IUPACN-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESFC(F)(F)c1cc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)c(C(F)(F)F)cc1/C=C\c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C56H38F6N2/c57-55(58,59)51-38-44(32-26-40-29-35-48(36-30-40)64(46-19-5-2-6-20-46)54-24-12-16-42-14-8-10-22-50(42)54)52(56(60,61)62)37-43(51)31-25-39-27-33-47(34-28-39)63(45-17-3-1-4-18-45)53-23-11-15-41-13-7-9-21-49(41)53/h1-38H/b31-25-,32-26+
InChIKeyNXYWXHXEKUZIJO-IEPGDLOPSA-N
MW852.92 g/mol
LogP17.31
Rot. Bonds10

About N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine

N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 162548483) has the molecular formula C56H38F6N2 and a molecular weight of 852.92 g/mol. Its IUPAC name is N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine
PubChem CID162548483
Molecular FormulaC56H38F6N2
Molecular Weight852.92 g/mol
Exact Mass852.29
IUPAC NameN-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESFC(F)(F)c1cc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)c(C(F)(F)F)cc1/C=C\c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C56H38F6N2/c57-55(58,59)51-38-44(32-26-40-29-35-48(36-30-40)64(46-19-5-2-6-20-46)54-24-12-16-42-14-8-10-22-50(42)54)52(56(60,61)62)37-43(51)31-25-39-27-33-47(34-28-39)63(45-17-3-1-4-18-45)53-23-11-15-41-13-7-9-21-49(41)53/h1-38H/b31-25-,32-26+
InChIKeyNXYWXHXEKUZIJO-IEPGDLOPSA-N
XLogP17.31
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500852.92
LogP ≤ 517.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(E)-2-[10-[(E)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]anthracen-9-yl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 143438529
4-N-[4-[2-[4-[2-[4-(N-[4-(dimethylamino)phenyl]anilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-1-N,1-N-dimethyl-4-N-phenylbenzene-1,4-diamine
CID 58932016
N-naphthalen-1-yl-6-[(E)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-N-phenylnaphthalen-2-amine
CID 59270592
N-[4-[(E)-2-[4-(4-tert-butyl-N-(4-tert-butylphenyl)anilino)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 89067517
N-naphthalen-1-yl-6-[(E)-2-[6-(N-naphthalen-1-ylanilino)naphthalen-2-yl]ethenyl]-N-phenylnaphthalen-2-amine
CID 58870889
N-naphthalen-1-yl-N-[4-[2-[4-[4-(N-phenylanilino)phenyl]phenyl]ethenyl]phenyl]naphthalen-1-amine
CID 59575121
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 87744556
N-[4-[(Z)-2-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]ethenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 160623452
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
N-[4-[2-[4-(4-tert-butyl-N-naphthalen-1-ylanilino)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 91122329
N-[4-[12-[4-[N-naphthalen-1-yl-4-[(Z)-2-phenylethenyl]anilino]phenyl]chrysen-6-yl]phenyl]-N-[4-(2-phenylethenyl)phenyl]naphthalen-1-amine
CID 163884704
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

Frequently Asked Questions

What is the IUPAC name of N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 162548483) is N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine is FC(F)(F)c1cc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)c(C(F)(F)F)cc1/C=C\c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is NXYWXHXEKUZIJO-IEPGDLOPSA-N. The full InChI is InChI=1S/C56H38F6N2/c57-55(58,59)51-38-44(32-26-40-29-35-48(36-30-40)64(46-19-5-2-6-20-46)54-24-12-16-42-14-8-10-22-50(42)54)52(56(60,61)62)37-43(51)31-25-39-27-33-47(34-28-39)63(45-17-3-1-4-18-45)53-23-11-15-41-13-7-9-21-49(41)53/h1-38H/b31-25-,32-26+.
What are the key properties of N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine?
N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 852.92 g/mol, XLogP of 17.31, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(E)-2-[4-[(Z)-2-[4-(N-naphthalen-1-ylanilino)phenyl]ethenyl]-2,5-bis(trifluoromethyl)phenyl]ethenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 162548483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).