1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine

C26H20N2 — CID 7142

IUPAC1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
SMILESc1ccc2cc(Nc3ccc(Nc4ccc5ccccc5c4)cc3)ccc2c1
InChIInChI=1S/C26H20N2/c1-3-7-21-17-25(11-9-19(21)5-1)27-23-13-15-24(16-14-23)28-26-12-10-20-6-2-4-8-22(20)18-26/h1-18,27-28H
InChIKeyVETPHHXZEJAYOB-UHFFFAOYSA-N
MW360.46 g/mol
LogP7.48
Rot. Bonds4

About 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine

1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine (PubChem CID 7142) has the molecular formula C26H20N2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine.

Molecular Properties

Compound Name1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
PubChem CID7142
Molecular FormulaC26H20N2
Molecular Weight360.46 g/mol
Exact Mass360.16
IUPAC Name1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
SMILESc1ccc2cc(Nc3ccc(Nc4ccc5ccccc5c4)cc3)ccc2c1
InChIInChI=1S/C26H20N2/c1-3-7-21-17-25(11-9-19(21)5-1)27-23-13-15-24(16-14-23)28-26-12-10-20-6-2-4-8-22(20)18-26/h1-18,27-28H
InChIKeyVETPHHXZEJAYOB-UHFFFAOYSA-N
XLogP7.48
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 57.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,6-N-diphenylnaphthalene-2,6-diamine
CID 12541294
N-pentacen-2-ylpentacen-2-amine
CID 91227915
4-N,4-N-dimethyl-1-N-naphthalen-2-ylbenzene-1,4-diamine
CID 82536280
nonane;N-phenylnaphthalen-2-amine
CID 159912384
6-[7-(4-bromophenyl)naphthalen-2-yl]-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 156573110
N-phenylphenanthren-2-amine
CID 23175030
N-naphthalen-2-ylanthracen-9-amine
CID 139983847
N,6-diphenylnaphthalen-2-amine
CID 67205043
4,5-dimethyl-1-N,2-N-dinaphthalen-2-ylbenzene-1,2-diamine
CID 121372627
naphthalen-2-yl-[4-[4-(naphthalen-2-ylamino)phenyl]phenyl]-diphenylazanium
CID 22269510
N-(3,4-dimethylphenyl)naphthalen-2-amine;N-methylnaphthalen-2-amine
CID 145088499
N-(4-pyren-1-ylphenyl)naphthalen-2-amine
CID 142720547

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine?
The IUPAC name of 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine (CID 7142) is 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine.
What is the SMILES notation for 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine?
The canonical SMILES for 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine is c1ccc2cc(Nc3ccc(Nc4ccc5ccccc5c4)cc3)ccc2c1.
What is the InChIKey of 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine?
The InChIKey is VETPHHXZEJAYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2/c1-3-7-21-17-25(11-9-19(21)5-1)27-23-13-15-24(16-14-23)28-26-12-10-20-6-2-4-8-22(20)18-26/h1-18,27-28H.
What are the key properties of 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine?
1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine has a molecular weight of 360.46 g/mol, XLogP of 7.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine is sourced from PubChem (CID 7142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).