N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline

C113H90N6 — CID 158086380

IUPACN-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline
SMILESCN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1c2ccccc2cc2ccccc12.CN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1cccc(-c2ccccc2)c1.CN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C39H30N2.2C37H30N2/c1-40(39-37-18-10-8-12-31(37)28-32-13-9-11-19-38(32)39)33-24-20-29(21-25-33)30-22-26-36(27-23-30)41(34-14-4-2-5-15-34)35-16-6-3-7-17-35;1-38(37-19-11-14-32(28-37)29-12-5-2-6-13-29)33-24-20-30(21-25-33)31-22-26-36(27-23-31)39(34-15-7-3-8-16-34)35-17-9-4-10-18-35;1-38(33-23-17-30(18-24-33)29-11-5-2-6-12-29)34-25-19-31(20-26-34)32-21-27-37(28-22-32)39(35-13-7-3-8-14-35)36-15-9-4-10-16-36/h2-28H,1H3;2*2-28H,1H3
InChIKeyFNOKFSWWYAJVPN-UHFFFAOYSA-N
MW1532.00 g/mol
LogP31.41
Rot. Bonds20

About N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline

N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline (PubChem CID 158086380) has the molecular formula C113H90N6 and a molecular weight of 1532.00 g/mol. Its IUPAC name is N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline.

Molecular Properties

Compound NameN-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline
PubChem CID158086380
Molecular FormulaC113H90N6
Molecular Weight1532.00 g/mol
Exact Mass1530.72
IUPAC NameN-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline
SMILESCN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1c2ccccc2cc2ccccc12.CN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1cccc(-c2ccccc2)c1.CN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C39H30N2.2C37H30N2/c1-40(39-37-18-10-8-12-31(37)28-32-13-9-11-19-38(32)39)33-24-20-29(21-25-33)30-22-26-36(27-23-30)41(34-14-4-2-5-15-34)35-16-6-3-7-17-35;1-38(37-19-11-14-32(28-37)29-12-5-2-6-13-29)33-24-20-30(21-25-33)31-22-26-36(27-23-31)39(34-15-7-3-8-16-34)35-17-9-4-10-18-35;1-38(33-23-17-30(18-24-33)29-11-5-2-6-12-29)34-25-19-31(20-26-34)32-21-27-37(28-22-32)39(35-13-7-3-8-14-35)36-15-9-4-10-16-36/h2-28H,1H3;2*2-28H,1H3
InChIKeyFNOKFSWWYAJVPN-UHFFFAOYSA-N
XLogP31.41
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds20
Heavy Atoms119
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001532.00
LogP ≤ 531.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline with MolForge

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Related Compounds

1-N-anthracen-9-yl-1-N-methyl-4-N,4-N-bis(3-phenylphenyl)benzene-1,4-diamine
CID 59431779
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-methylanthracen-9-amine;N-[4-[4-(N-methyl-3-phenylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(N-methyl-4-phenylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 160818621
1-N-anthracen-2-yl-1-N-methyl-4-N-phenyl-4-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-anthracen-9-yl-1-N-methyl-4-N-phenyl-4-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N-phenyl-1-N,4-N-bis(3-phenylphenyl)benzene-1,4-diamine
CID 159221437
1-N-anthracen-2-yl-1-N-methyl-4-N-(4-methylphenyl)-4-N-phenylbenzene-1,4-diamine;1-N-anthracen-9-yl-1-N-methyl-4-N-(4-methylphenyl)-4-N-phenylbenzene-1,4-diamine;1-N-methyl-4-N-(4-methylphenyl)-4-N-phenyl-1-N-(3-phenylphenyl)benzene-1,4-diamine
CID 158312498
N-methyl-N-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]anthracen-2-amine;N-methyl-N-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]anthracen-9-amine
CID 158787356
N-methyl-N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]anthracen-2-amine;N-methyl-N-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]anthracen-9-amine
CID 158426731
1-N-methyl-1-N-(4-methylanthracen-9-yl)-4-N-phenyl-4-N-(3-phenylphenyl)benzene-1,4-diamine
CID 89265087
N-[4-[4-(N-methyl-3-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-2-amine
CID 59431625
N-[4-[4-(N-methyl-3-phenylanilino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 59431911
1-N-methyl-4-N,4-N-dinaphthalen-2-yl-1-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-2-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine;1-N-methyl-1-N,4-N,4-N-trinaphthalen-2-ylbenzene-1,4-diamine
CID 159683309
N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-methylanthracen-9-amine
CID 59431812
N-methyl-N-phenylanthracen-9-amine
CID 22944738

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline?
The IUPAC name of N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline (CID 158086380) is N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline.
What is the SMILES notation for N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline?
The canonical SMILES for N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline is CN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1c2ccccc2cc2ccccc12.CN(c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)c1cccc(-c2ccccc2)c1.CN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline?
The InChIKey is FNOKFSWWYAJVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H30N2.2C37H30N2/c1-40(39-37-18-10-8-12-31(37)28-32-13-9-11-19-38(32)39)33-24-20-29(21-25-33)30-22-26-36(27-23-30)41(34-14-4-2-5-15-34)35-16-6-3-7-17-35;1-38(37-19-11-14-32(28-37)29-12-5-2-6-13-29)33-24-20-30(21-25-33)31-22-26-36(27-23-31)39(34-15-7-3-8-16-34)35-17-9-4-10-18-35;1-38(33-23-17-30(18-24-33)29-11-5-2-6-12-29)34-25-19-31(20-26-34)32-21-27-37(28-22-32)39(35-13-7-3-8-14-35)36-15-9-4-10-16-36/h2-28H,1H3;2*2-28H,1H3.
What are the key properties of N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline?
N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline has a molecular weight of 1532.00 g/mol, XLogP of 31.41, 20 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anthracen-9-amine;N-methyl-3-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N-methyl-4-phenyl-N-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline is sourced from PubChem (CID 158086380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).