N-(2,5-diphenylphenyl)naphthalen-1-amine

C28H21N — CID 174398533

IUPACN-(2,5-diphenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2ccc(-c3ccccc3)c(Nc3cccc4ccccc34)c2)cc1
InChIInChI=1S/C28H21N/c1-3-10-21(11-4-1)24-18-19-26(22-12-5-2-6-13-22)28(20-24)29-27-17-9-15-23-14-7-8-16-25(23)27/h1-20,29H
InChIKeyAUVSHQFHYRDPMY-UHFFFAOYSA-N
MW371.48 g/mol
LogP7.92
Rot. Bonds4

About N-(2,5-diphenylphenyl)naphthalen-1-amine

N-(2,5-diphenylphenyl)naphthalen-1-amine (PubChem CID 174398533) has the molecular formula C28H21N and a molecular weight of 371.48 g/mol. Its IUPAC name is N-(2,5-diphenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-(2,5-diphenylphenyl)naphthalen-1-amine
PubChem CID174398533
Molecular FormulaC28H21N
Molecular Weight371.48 g/mol
Exact Mass371.17
IUPAC NameN-(2,5-diphenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2ccc(-c3ccccc3)c(Nc3cccc4ccccc34)c2)cc1
InChIInChI=1S/C28H21N/c1-3-10-21(11-4-1)24-18-19-26(22-12-5-2-6-13-22)28(20-24)29-27-17-9-15-23-14-7-8-16-25(23)27/h1-20,29H
InChIKeyAUVSHQFHYRDPMY-UHFFFAOYSA-N
XLogP7.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 57.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-diphenylphenyl)naphthalen-1-amine?
The IUPAC name of N-(2,5-diphenylphenyl)naphthalen-1-amine (CID 174398533) is N-(2,5-diphenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-(2,5-diphenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-(2,5-diphenylphenyl)naphthalen-1-amine is c1ccc(-c2ccc(-c3ccccc3)c(Nc3cccc4ccccc34)c2)cc1.
What is the InChIKey of N-(2,5-diphenylphenyl)naphthalen-1-amine?
The InChIKey is AUVSHQFHYRDPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N/c1-3-10-21(11-4-1)24-18-19-26(22-12-5-2-6-13-22)28(20-24)29-27-17-9-15-23-14-7-8-16-25(23)27/h1-20,29H.
What are the key properties of N-(2,5-diphenylphenyl)naphthalen-1-amine?
N-(2,5-diphenylphenyl)naphthalen-1-amine has a molecular weight of 371.48 g/mol, XLogP of 7.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diphenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 174398533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).