5-naphthalen-1-yl-N,2-diphenylaniline

C28H21N — CID 175302178

IUPAC5-naphthalen-1-yl-N,2-diphenylaniline
SMILESc1ccc(Nc2cc(-c3cccc4ccccc34)ccc2-c2ccccc2)cc1
InChIInChI=1S/C28H21N/c1-3-10-22(11-4-1)27-19-18-23(20-28(27)29-24-14-5-2-6-15-24)26-17-9-13-21-12-7-8-16-25(21)26/h1-20,29H
InChIKeyZOVCXYSEBDTYLQ-UHFFFAOYSA-N
MW371.48 g/mol
LogP7.92
Rot. Bonds4

About 5-naphthalen-1-yl-N,2-diphenylaniline

5-naphthalen-1-yl-N,2-diphenylaniline (PubChem CID 175302178) has the molecular formula C28H21N and a molecular weight of 371.48 g/mol. Its IUPAC name is 5-naphthalen-1-yl-N,2-diphenylaniline.

Molecular Properties

Compound Name5-naphthalen-1-yl-N,2-diphenylaniline
PubChem CID175302178
Molecular FormulaC28H21N
Molecular Weight371.48 g/mol
Exact Mass371.17
IUPAC Name5-naphthalen-1-yl-N,2-diphenylaniline
SMILESc1ccc(Nc2cc(-c3cccc4ccccc34)ccc2-c2ccccc2)cc1
InChIInChI=1S/C28H21N/c1-3-10-22(11-4-1)27-19-18-23(20-28(27)29-24-14-5-2-6-15-24)26-17-9-13-21-12-7-8-16-25(21)26/h1-20,29H
InChIKeyZOVCXYSEBDTYLQ-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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Related Compounds

N-(3-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)aniline
CID 177069740
N-(2,5-diphenylphenyl)naphthalen-1-amine
CID 174398533
2-[2-(4-naphthalen-1-ylanilino)phenyl]-N-(4-phenylphenyl)aniline
CID 139322198
3-N-(3-naphthalen-1-ylphenyl)-1-N-phenylbenzene-1,3-diamine
CID 139380119
2-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)aniline
CID 126709673
N-(4-naphthalen-1-ylphenyl)phenanthren-9-amine
CID 134359527
2-phenanthren-1-yl-N-[4-(4-phenylnaphthalen-1-yl)phenyl]aniline
CID 168764813
ethane;methanethiol;N-(4-naphthalen-1-ylphenyl)-2,4-diphenylaniline
CID 145442322
7-naphthalen-1-yl-N-phenylnaphthalen-2-amine
CID 166714630
N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59029878
N-[4-[4-(naphthalen-1-ylamino)-2-phenylphenyl]-3-phenylphenyl]naphthalen-1-amine
CID 22134300
4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline
CID 66605145

Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-yl-N,2-diphenylaniline?
The IUPAC name of 5-naphthalen-1-yl-N,2-diphenylaniline (CID 175302178) is 5-naphthalen-1-yl-N,2-diphenylaniline.
What is the SMILES notation for 5-naphthalen-1-yl-N,2-diphenylaniline?
The canonical SMILES for 5-naphthalen-1-yl-N,2-diphenylaniline is c1ccc(Nc2cc(-c3cccc4ccccc34)ccc2-c2ccccc2)cc1.
What is the InChIKey of 5-naphthalen-1-yl-N,2-diphenylaniline?
The InChIKey is ZOVCXYSEBDTYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N/c1-3-10-22(11-4-1)27-19-18-23(20-28(27)29-24-14-5-2-6-15-24)26-17-9-13-21-12-7-8-16-25(21)26/h1-20,29H.
What are the key properties of 5-naphthalen-1-yl-N,2-diphenylaniline?
5-naphthalen-1-yl-N,2-diphenylaniline 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 5-naphthalen-1-yl-N,2-diphenylaniline is sourced from PubChem (CID 175302178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).