N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine

C45H32N2 — CID 122425491

IUPACN-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
SMILESc1cc(-c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3)cc2)cc(N2c3ccccc3Cc3ccccc32)c1
InChIInChI=1S/C45H32N2/c1-3-12-35-30-42(26-22-32(35)10-1)46(43-27-23-33-11-2-4-13-36(33)31-43)40-24-20-34(21-25-40)37-16-9-17-41(29-37)47-44-18-7-5-14-38(44)28-39-15-6-8-19-45(39)47/h1-27,29-31H,28H2
InChIKeyIXLAIGDBZYNDOQ-UHFFFAOYSA-N
MW600.77 g/mol
LogP12.50
Rot. Bonds5

About N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine

N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine (PubChem CID 122425491) has the molecular formula C45H32N2 and a molecular weight of 600.77 g/mol. Its IUPAC name is N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
PubChem CID122425491
Molecular FormulaC45H32N2
Molecular Weight600.77 g/mol
Exact Mass600.26
IUPAC NameN-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
SMILESc1cc(-c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3)cc2)cc(N2c3ccccc3Cc3ccccc32)c1
InChIInChI=1S/C45H32N2/c1-3-12-35-30-42(26-22-32(35)10-1)46(43-27-23-33-11-2-4-13-36(33)31-43)40-24-20-34(21-25-40)37-16-9-17-41(29-37)47-44-18-7-5-14-38(44)28-39-15-6-8-19-45(39)47/h1-27,29-31H,28H2
InChIKeyIXLAIGDBZYNDOQ-UHFFFAOYSA-N
XLogP12.50
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500600.77
LogP ≤ 512.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[7-naphthalen-1-yl-10-(4-phenylphenyl)-9H-acridin-2-yl]phenyl]-N-phenylnaphthalen-2-amine;N-phenyl-N-[4-[10-(4-phenylphenyl)-9H-acridin-2-yl]phenyl]naphthalen-2-amine;N-phenyl-N-[4-[7-phenyl-10-(4-phenylphenyl)-9H-acridin-2-yl]phenyl]naphthalen-2-amine
CID 158909774
N,N-diphenyl-4-[10-(4-phenylphenyl)-9H-acridin-2-yl]aniline;4-(7-naphthalen-1-yl-10-phenyl-9H-acridin-2-yl)-N,N-diphenylaniline;4-(7-naphthalen-2-yl-10-phenyl-9H-acridin-2-yl)-N,N-diphenylaniline
CID 158959762
7-methyl-N-[4-[4-(N-[7-methyl-10-(4-methylphenyl)-9H-acridin-2-yl]anilino)phenyl]phenyl]-10-(4-methylphenyl)-N-phenyl-9H-acridin-2-amine;N-naphthalen-2-yl-N-[4-[4-[naphthalen-1-yl-(10-phenyl-9H-acridin-2-yl)amino]phenyl]phenyl]-10-phenyl-9H-acridin-2-amine;10-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(10-phenyl-9H-acridin-2-yl)anilino)phenyl]phenyl]-9H-acridin-2-amine
CID 158962449
N-[4-[3-[3-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 121286442
bis(N,N-bis[4-[3-(9H-acridin-10-yl)phenyl]phenyl]dibenzofuran-3-amine);tris(N,N-bis[4-[3-(9H-acridin-10-yl)phenyl]phenyl]phenanthren-9-amine);N,N-bis[4-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]phenanthren-9-amine
CID 157390854
methane;4-N-naphthalen-1-yl-1-N-[4-[4-[2-(N-naphthalen-1-ylanilino)-9H-acridin-10-yl]phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 160648870
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
N-[4-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 59029881
N-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 153292153
bis(N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-(3,4-diphenylphenyl)-3,4-diphenylaniline);bis(N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-(3,5-diphenylphenyl)-3,5-diphenylaniline);N-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]-N-(3,4-diphenylphenyl)-3,4-diphenylaniline;N-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]-N-(3,5-diphenylphenyl)-3,5-diphenylaniline;N-(3,4-diphenylphenyl)-3,4-diphenyl-N-[4-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]aniline;N-(3,5-diphenylphenyl)-3,5-diphenyl-N-[4-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]aniline
CID 158494405
N-[4-(3-phenoxazin-10-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 122425440
N,N-bis[4-(3-phenoxazin-10-ylphenyl)phenyl]-4-phenylaniline
CID 122425451

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The IUPAC name of N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine (CID 122425491) is N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine.
What is the SMILES notation for N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The canonical SMILES for N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine is c1cc(-c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3)cc2)cc(N2c3ccccc3Cc3ccccc32)c1.
What is the InChIKey of N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
The InChIKey is IXLAIGDBZYNDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H32N2/c1-3-12-35-30-42(26-22-32(35)10-1)46(43-27-23-33-11-2-4-13-36(33)31-43)40-24-20-34(21-25-40)37-16-9-17-41(29-37)47-44-18-7-5-14-38(44)28-39-15-6-8-19-45(39)47/h1-27,29-31H,28H2.
What are the key properties of N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine?
N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine has a molecular weight of 600.77 g/mol, XLogP of 12.50, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(9H-acridin-10-yl)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine is sourced from PubChem (CID 122425491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).