4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline

C34H26N2 — CID 66605145

IUPAC4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline
SMILESc1ccc(Nc2ccc(-c3ccc(Nc4ccccc4)c(-c4cccc5ccccc45)c3)cc2)cc1
InChIInChI=1S/C34H26N2/c1-3-12-28(13-4-1)35-30-21-18-25(19-22-30)27-20-23-34(36-29-14-5-2-6-15-29)33(24-27)32-17-9-11-26-10-7-8-16-31(26)32/h1-24,35-36H
InChIKeyBLSVIXTWKGEVSH-UHFFFAOYSA-N
MW462.60 g/mol
LogP9.66
Rot. Bonds6

About 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline

4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline (PubChem CID 66605145) has the molecular formula C34H26N2 and a molecular weight of 462.60 g/mol. Its IUPAC name is 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline.

Molecular Properties

Compound Name4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline
PubChem CID66605145
Molecular FormulaC34H26N2
Molecular Weight462.60 g/mol
Exact Mass462.21
IUPAC Name4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline
SMILESc1ccc(Nc2ccc(-c3ccc(Nc4ccccc4)c(-c4cccc5ccccc45)c3)cc2)cc1
InChIInChI=1S/C34H26N2/c1-3-12-28(13-4-1)35-30-21-18-25(19-22-30)27-20-23-34(36-29-14-5-2-6-15-29)33(24-27)32-17-9-11-26-10-7-8-16-31(26)32/h1-24,35-36H
InChIKeyBLSVIXTWKGEVSH-UHFFFAOYSA-N
XLogP9.66
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.60
LogP ≤ 59.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;methanethiol;N-(4-naphthalen-1-ylphenyl)-2,4-diphenylaniline
CID 145442322
2-[2-(4-naphthalen-1-ylanilino)phenyl]-N-(4-phenylphenyl)aniline
CID 139322198
N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 58672315
2-naphthalen-2-yl-N-[4-[4-(2-naphthalen-1-ylanilino)phenyl]phenyl]aniline
CID 69101182
N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59029878
N,2-diphenyl-4-[3-phenyl-4-[4-(4-phenylphenyl)anilino]phenyl]aniline
CID 121262444
N-(3-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)aniline
CID 177069740
7-naphthalen-1-yl-N-phenylnaphthalen-2-amine
CID 166714630
5-naphthalen-1-yl-N,2-diphenylaniline
CID 175302178
2-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)aniline
CID 126709673
4-(4-anilinophenyl)-2-(3-methylphenyl)-N-phenylaniline
CID 67215708
4-N-[2-[4-(phenanthren-9-ylamino)phenyl]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 130250792

Frequently Asked Questions

What is the IUPAC name of 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline?
The IUPAC name of 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline (CID 66605145) is 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline.
What is the SMILES notation for 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline?
The canonical SMILES for 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline is c1ccc(Nc2ccc(-c3ccc(Nc4ccccc4)c(-c4cccc5ccccc45)c3)cc2)cc1.
What is the InChIKey of 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline?
The InChIKey is BLSVIXTWKGEVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N2/c1-3-12-28(13-4-1)35-30-21-18-25(19-22-30)27-20-23-34(36-29-14-5-2-6-15-29)33(24-27)32-17-9-11-26-10-7-8-16-31(26)32/h1-24,35-36H.
What are the key properties of 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline?
4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline has a molecular weight of 462.60 g/mol, XLogP of 9.66, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-anilinophenyl)-2-naphthalen-1-yl-N-phenylaniline is sourced from PubChem (CID 66605145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).