9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine

C54H39N3 — CID 121259026

IUPAC9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccn4)cc3)c3ccc4c(c3)N(c3ccccc3)c3ccccc3C4(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C54H39N3/c1-5-17-40(18-6-1)41-28-32-46(33-29-41)56(47-34-30-42(31-35-47)51-26-15-16-38-55-51)48-36-37-50-53(39-48)57(45-23-11-4-12-24-45)52-27-14-13-25-49(52)54(50,43-19-7-2-8-20-43)44-21-9-3-10-22-44/h1-39H
InChIKeyNUYJIZDJSUDIAH-UHFFFAOYSA-N
MW729.93 g/mol
LogP14.05
Rot. Bonds8

About 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine

9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine (PubChem CID 121259026) has the molecular formula C54H39N3 and a molecular weight of 729.93 g/mol. Its IUPAC name is 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine.

Molecular Properties

Compound Name9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine
PubChem CID121259026
Molecular FormulaC54H39N3
Molecular Weight729.93 g/mol
Exact Mass729.31
IUPAC Name9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccn4)cc3)c3ccc4c(c3)N(c3ccccc3)c3ccccc3C4(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C54H39N3/c1-5-17-40(18-6-1)41-28-32-46(33-29-41)56(47-34-30-42(31-35-47)51-26-15-16-38-55-51)48-36-37-50-53(39-48)57(45-23-11-4-12-24-45)52-27-14-13-25-49(52)54(50,43-19-7-2-8-20-43)44-21-9-3-10-22-44/h1-39H
InChIKeyNUYJIZDJSUDIAH-UHFFFAOYSA-N
XLogP14.05
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms57
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500729.93
LogP ≤ 514.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine?
The IUPAC name of 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine (CID 121259026) is 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine.
What is the SMILES notation for 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine?
The canonical SMILES for 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccn4)cc3)c3ccc4c(c3)N(c3ccccc3)c3ccccc3C4(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine?
The InChIKey is NUYJIZDJSUDIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H39N3/c1-5-17-40(18-6-1)41-28-32-46(33-29-41)56(47-34-30-42(31-35-47)51-26-15-16-38-55-51)48-36-37-50-53(39-48)57(45-23-11-4-12-24-45)52-27-14-13-25-49(52)54(50,43-19-7-2-8-20-43)44-21-9-3-10-22-44/h1-39H.
What are the key properties of 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine?
9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine has a molecular weight of 729.93 g/mol, XLogP of 14.05, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9,10-triphenyl-N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)acridin-3-amine is sourced from PubChem (CID 121259026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).