N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine

C52H37N — CID 166679452

IUPACN,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3cccc(N(c4ccccc4)c4ccc5ccc(-c6ccccc6)cc5c4)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C52H37N/c1-6-17-38(18-7-1)43-30-29-40-31-32-49(35-45(40)33-43)53(47-26-14-5-15-27-47)48-28-16-25-44(34-48)52-50(41-21-10-3-11-22-41)36-46(39-19-8-2-9-20-39)37-51(52)42-23-12-4-13-24-42/h1-37H
InChIKeyACHZFJNYDNXMSY-UHFFFAOYSA-N
MW675.88 g/mol
LogP14.64
Rot. Bonds8

About N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine

N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine (PubChem CID 166679452) has the molecular formula C52H37N and a molecular weight of 675.88 g/mol. Its IUPAC name is N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine.

Molecular Properties

Compound NameN,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine
PubChem CID166679452
Molecular FormulaC52H37N
Molecular Weight675.88 g/mol
Exact Mass675.29
IUPAC NameN,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3cccc(N(c4ccccc4)c4ccc5ccc(-c6ccccc6)cc5c4)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C52H37N/c1-6-17-38(18-7-1)43-30-29-40-31-32-49(35-45(40)33-43)53(47-26-14-5-15-27-47)48-28-16-25-44(34-48)52-50(41-21-10-3-11-22-41)36-46(39-19-8-2-9-20-39)37-51(52)42-23-12-4-13-24-42/h1-37H
InChIKeyACHZFJNYDNXMSY-UHFFFAOYSA-N
XLogP14.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500675.88
LogP ≤ 514.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-3-(2,4,6-triphenylphenyl)aniline
CID 126492683
N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 166916774
N-(4-naphthalen-2-ylphenyl)-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-1-amine
CID 166676735
N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-[3-(2,3,5-triphenylphenyl)phenyl]phenyl]aniline
CID 175802280
N-(4-naphthalen-1-ylphenyl)-N-phenyl-3-(2,4,6-triphenylphenyl)aniline
CID 166679444
N-(4-naphthalen-2-ylphenyl)-3,4-diphenyl-N-[4-(2,4,6-triphenylphenyl)phenyl]aniline
CID 156808676
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
3-naphthalen-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 167236634
N-phenyl-4-(7-phenylnaphthalen-2-yl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 139352483
16-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaen-6-amine
CID 166031712
N-[4-(3-naphthalen-2-ylphenyl)phenyl]-3-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline
CID 166566338
N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-3-phenyl-N-(3-phenylphenyl)aniline
CID 166565645

Frequently Asked Questions

What is the IUPAC name of N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine?
The IUPAC name of N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine (CID 166679452) is N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine.
What is the SMILES notation for N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine?
The canonical SMILES for N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine is c1ccc(-c2cc(-c3ccccc3)c(-c3cccc(N(c4ccccc4)c4ccc5ccc(-c6ccccc6)cc5c4)c3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine?
The InChIKey is ACHZFJNYDNXMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H37N/c1-6-17-38(18-7-1)43-30-29-40-31-32-49(35-45(40)33-43)53(47-26-14-5-15-27-47)48-28-16-25-44(34-48)52-50(41-21-10-3-11-22-41)36-46(39-19-8-2-9-20-39)37-51(52)42-23-12-4-13-24-42/h1-37H.
What are the key properties of N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine?
N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine has a molecular weight of 675.88 g/mol, XLogP of 14.64, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-diphenyl-N-[3-(2,4,6-triphenylphenyl)phenyl]naphthalen-2-amine is sourced from PubChem (CID 166679452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).