N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine

C108H90N6O — CID 160664392

IUPACN-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCOc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1cccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c1
InChIInChI=1S/C36H30N2O.2C36H30N2/c1-37(31-23-25-34(39-2)26-24-31)30-19-15-27(16-20-30)28-17-21-33(22-18-28)38(32-11-4-3-5-12-32)36-14-8-10-29-9-6-7-13-35(29)36;1-27-10-8-15-34(26-27)37(2)31-22-18-28(19-23-31)29-20-24-33(25-21-29)38(32-13-4-3-5-14-32)36-17-9-12-30-11-6-7-16-35(30)36;1-27-15-21-31(22-16-27)37(2)32-23-17-28(18-24-32)29-19-25-34(26-20-29)38(33-11-4-3-5-12-33)36-14-8-10-30-9-6-7-13-35(30)36/h3-26H,1-2H3;2*3-26H,1-2H3
InChIKeyRMCFYWSTVOYPQS-UHFFFAOYSA-N
MW1487.95 g/mol
LogP29.86
Rot. Bonds19

About N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine

N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 160664392) has the molecular formula C108H90N6O and a molecular weight of 1487.95 g/mol. Its IUPAC name is N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound NameN-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
PubChem CID160664392
Molecular FormulaC108H90N6O
Molecular Weight1487.95 g/mol
Exact Mass1486.72
IUPAC NameN-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCOc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1cccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c1
InChIInChI=1S/C36H30N2O.2C36H30N2/c1-37(31-23-25-34(39-2)26-24-31)30-19-15-27(16-20-30)28-17-21-33(22-18-28)38(32-11-4-3-5-12-32)36-14-8-10-29-9-6-7-13-35(29)36;1-27-10-8-15-34(26-27)37(2)31-22-18-28(19-23-31)29-20-24-33(25-21-29)38(32-13-4-3-5-14-32)36-17-9-12-30-11-6-7-16-35(30)36;1-27-15-21-31(22-16-27)37(2)32-23-17-28(18-24-32)29-19-25-34(26-20-29)38(33-11-4-3-5-12-33)36-14-8-10-30-9-6-7-13-35(30)36/h3-26H,1-2H3;2*3-26H,1-2H3
InChIKeyRMCFYWSTVOYPQS-UHFFFAOYSA-N
XLogP29.86
TPSA28.67 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds19
Heavy Atoms115
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001487.95
LogP ≤ 529.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 160664392) is N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine is COc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1ccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1.Cc1cccc(N(C)c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)c1.
What is the InChIKey of N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is RMCFYWSTVOYPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H30N2O.2C36H30N2/c1-37(31-23-25-34(39-2)26-24-31)30-19-15-27(16-20-30)28-17-21-33(22-18-28)38(32-11-4-3-5-12-32)36-14-8-10-29-9-6-7-13-35(29)36;1-27-10-8-15-34(26-27)37(2)31-22-18-28(19-23-31)29-20-24-33(25-21-29)38(32-13-4-3-5-14-32)36-17-9-12-30-11-6-7-16-35(30)36;1-27-15-21-31(22-16-27)37(2)32-23-17-28(18-24-32)29-19-25-34(26-20-29)38(33-11-4-3-5-12-33)36-14-8-10-30-9-6-7-13-35(30)36/h3-26H,1-2H3;2*3-26H,1-2H3.
What are the key properties of N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 1487.95 g/mol, XLogP of 29.86, 19 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(N,3-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(N,4-dimethylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[4-(4-methoxy-N-methylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 160664392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).