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

C115H88N6 — CID 159683309

IUPAC1-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
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/2C39H30N2.C37H28N2/c1-40(37-17-9-16-34(26-37)29-10-3-2-4-11-29)35-22-24-36(25-23-35)41(38-20-18-30-12-5-7-14-32(30)27-38)39-21-19-31-13-6-8-15-33(31)28-39;1-40(35-19-15-32(16-20-35)29-9-3-2-4-10-29)36-23-25-37(26-24-36)41(38-21-17-30-11-5-7-13-33(30)27-38)39-22-18-31-12-6-8-14-34(31)28-39;1-38(35-17-14-27-8-2-5-11-30(27)24-35)33-20-22-34(23-21-33)39(36-18-15-28-9-3-6-12-31(28)25-36)37-19-16-29-10-4-7-13-32(29)26-37/h2*2-28H,1H3;2-26H,1H3
InChIKeyMVLXVLNOPLZZPO-UHFFFAOYSA-N
MW1554.01 g/mol
LogP32.18
Rot. Bonds17

About 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

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 (PubChem CID 159683309) has the molecular formula C115H88N6 and a molecular weight of 1554.01 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name1-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
PubChem CID159683309
Molecular FormulaC115H88N6
Molecular Weight1554.01 g/mol
Exact Mass1552.71
IUPAC Name1-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
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/2C39H30N2.C37H28N2/c1-40(37-17-9-16-34(26-37)29-10-3-2-4-11-29)35-22-24-36(25-23-35)41(38-20-18-30-12-5-7-14-32(30)27-38)39-21-19-31-13-6-8-15-33(31)28-39;1-40(35-19-15-32(16-20-35)29-9-3-2-4-10-29)36-23-25-37(26-24-36)41(38-21-17-30-11-5-7-13-33(30)27-38)39-22-18-31-12-6-8-14-34(31)28-39;1-38(35-17-14-27-8-2-5-11-30(27)24-35)33-20-22-34(23-21-33)39(36-18-15-28-9-3-6-12-31(28)25-36)37-19-16-29-10-4-7-13-32(29)26-37/h2*2-28H,1H3;2-26H,1H3
InChIKeyMVLXVLNOPLZZPO-UHFFFAOYSA-N
XLogP32.18
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms121
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001554.01
LogP ≤ 532.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 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 with MolForge

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Related Compounds

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
N-methyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]naphthalen-2-amine;N-methyl-4-phenyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 158523438
N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-methylnaphthalen-2-amine;N-[4-[4-(N-methyl-4-phenylanilino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 161479413
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
N-[4-[4-(N-methylanilino)phenyl]phenyl]-N-(3-phenylphenyl)naphthalen-1-amine;N-methyl-N-[4-[4-(N-naphthalen-1-yl-3-phenylanilino)phenyl]phenyl]naphthalen-2-amine
CID 159163258
N-methyl-N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]anthracen-2-amine
CID 59431583
N-methyl-N-phenylaniline;4-naphthalen-2-yl-N,N-diphenylaniline
CID 145077482
1-N-methyl-4-N,4-N-diphenyl-1-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N,4-N-diphenyl-1-N-(4-phenylphenyl)benzene-1,4-diamine;1-N-methyl-1-N-naphthalen-1-yl-4-N,4-N-diphenylbenzene-1,4-diamine;1-N-methyl-1-N-naphthalen-2-yl-4-N,4-N-diphenylbenzene-1,4-diamine
CID 159975441
1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-naphthalen-2-ylbenzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-(3-phenylphenyl)benzene-1,4-diamine;1-N-methyl-4-N,4-N-dinaphthalen-1-yl-1-N-(4-phenylphenyl)benzene-1,4-diamine
CID 158106660
3-naphthalen-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 167236634
N-methyl-3-naphthalen-2-yl-N-phenylaniline
CID 149001874

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CN(c1ccc(-c2ccccc2)cc1)c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1.CN(c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)c1cccc(-c2ccccc2)c1.
What is the InChIKey of 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?
The InChIKey is MVLXVLNOPLZZPO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C39H30N2.C37H28N2/c1-40(37-17-9-16-34(26-37)29-10-3-2-4-11-29)35-22-24-36(25-23-35)41(38-20-18-30-12-5-7-14-32(30)27-38)39-21-19-31-13-6-8-15-33(31)28-39;1-40(35-19-15-32(16-20-35)29-9-3-2-4-10-29)36-23-25-37(26-24-36)41(38-21-17-30-11-5-7-13-33(30)27-38)39-22-18-31-12-6-8-14-34(31)28-39;1-38(35-17-14-27-8-2-5-11-30(27)24-35)33-20-22-34(23-21-33)39(36-18-15-28-9-3-6-12-31(28)25-36)37-19-16-29-10-4-7-13-32(29)26-37/h2*2-28H,1H3;2-26H,1H3.
What are the key properties of 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?
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 has a molecular weight of 1554.01 g/mol, XLogP of 32.18, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159683309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).