6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine

C44H29NO — CID 118406083

IUPAC6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine
SMILESc1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc1
InChIInChI=1S/C44H29NO/c1-2-11-36(12-3-1)45(37-23-19-31(20-24-37)40-15-8-10-30-9-4-5-13-39(30)40)38-25-21-33-27-32(17-18-34(33)28-38)35-22-26-44-42(29-35)41-14-6-7-16-43(41)46-44/h1-29H
InChIKeyMDOPPMMORZDKPH-UHFFFAOYSA-N
MW587.72 g/mol
LogP12.70
Rot. Bonds5

About 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine

6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine (PubChem CID 118406083) has the molecular formula C44H29NO and a molecular weight of 587.72 g/mol. Its IUPAC name is 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine.

Molecular Properties

Compound Name6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine
PubChem CID118406083
Molecular FormulaC44H29NO
Molecular Weight587.72 g/mol
Exact Mass587.22
IUPAC Name6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine
SMILESc1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc1
InChIInChI=1S/C44H29NO/c1-2-11-36(12-3-1)45(37-23-19-31(20-24-37)40-15-8-10-30-9-4-5-13-39(30)40)38-25-21-33-27-32(17-18-34(33)28-38)35-22-26-44-42(29-35)41-14-6-7-16-43(41)46-44/h1-29H
InChIKeyMDOPPMMORZDKPH-UHFFFAOYSA-N
XLogP12.70
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500587.72
LogP ≤ 512.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-dibenzofuran-2-yl-N-(3-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 170535241
3-dibenzofuran-2-yl-N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 170535389
N-(8-naphthalen-2-ylnaphthalen-2-yl)-N-phenyldibenzofuran-2-amine
CID 176588075
N-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)dibenzofuran-2-amine
CID 121325430
8-naphthalen-1-yl-N,N-diphenyldibenzofuran-2-amine
CID 130208127
9-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenyldibenzofuran-2-amine
CID 166055376
N-(4-chrysen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-2-amine
CID 170137599
N-(4-dibenzofuran-2-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 166566167
3-dibenzofuran-2-yl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline
CID 170535051
N-(4-naphthalen-1-ylphenyl)-4-naphtho[2,1-b][1]benzofuran-3-yl-N-phenylaniline
CID 170030516
N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 157368464
N,N-bis(4-dibenzofuran-2-ylphenyl)-3,5-diphenylaniline;N,N-bis(4-dibenzofuran-2-ylphenyl)-4-(4-naphthalen-1-ylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 157066218

Frequently Asked Questions

What is the IUPAC name of 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine?
The IUPAC name of 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine (CID 118406083) is 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine.
What is the SMILES notation for 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine?
The canonical SMILES for 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine is c1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc1.
What is the InChIKey of 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine?
The InChIKey is MDOPPMMORZDKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29NO/c1-2-11-36(12-3-1)45(37-23-19-31(20-24-37)40-15-8-10-30-9-4-5-13-39(30)40)38-25-21-33-27-32(17-18-34(33)28-38)35-22-26-44-42(29-35)41-14-6-7-16-43(41)46-44/h1-29H.
What are the key properties of 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine?
6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine has a molecular weight of 587.72 g/mol, XLogP of 12.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine is sourced from PubChem (CID 118406083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).