4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine

C74H48N2O — CID 168848073

IUPAC4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccccc4-c4ccc(N(c5ccc(-c6ccc(-c7cccc8ccccc78)cc6)cc5)c5ccc(-c6cccc7ccccc67)c6oc7ccccc7c56)cc4)cccc32)cc1
InChIInChI=1S/C74H48N2O/c1-2-21-55(22-3-1)76-68-32-12-10-27-66(68)72-64(31-16-33-69(72)76)62-26-9-8-25-61(62)54-41-45-57(46-42-54)75(56-43-39-50(40-44-56)49-35-37-53(38-36-49)59-29-14-19-51-17-4-6-23-58(51)59)70-48-47-65(63-30-15-20-52-18-5-7-24-60(52)63)74-73(70)67-28-11-13-34-71(67)77-74/h1-48H
InChIKeyWJGJSWLWNVFYEK-UHFFFAOYSA-N
MW981.21 g/mol
LogP20.79
Rot. Bonds9

About 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine

4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine (PubChem CID 168848073) has the molecular formula C74H48N2O and a molecular weight of 981.21 g/mol. Its IUPAC name is 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine.

Molecular Properties

Compound Name4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine
PubChem CID168848073
Molecular FormulaC74H48N2O
Molecular Weight981.21 g/mol
Exact Mass980.38
IUPAC Name4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccccc4-c4ccc(N(c5ccc(-c6ccc(-c7cccc8ccccc78)cc6)cc5)c5ccc(-c6cccc7ccccc67)c6oc7ccccc7c56)cc4)cccc32)cc1
InChIInChI=1S/C74H48N2O/c1-2-21-55(22-3-1)76-68-32-12-10-27-66(68)72-64(31-16-33-69(72)76)62-26-9-8-25-61(62)54-41-45-57(46-42-54)75(56-43-39-50(40-44-56)49-35-37-53(38-36-49)59-29-14-19-51-17-4-6-23-58(51)59)70-48-47-65(63-30-15-20-52-18-5-7-24-60(52)63)74-73(70)67-28-11-13-34-71(67)77-74/h1-48H
InChIKeyWJGJSWLWNVFYEK-UHFFFAOYSA-N
XLogP20.79
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms77
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500981.21
LogP ≤ 520.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-naphthalen-1-yldibenzofuran-1-yl)-N-(4-naphthalen-1-ylphenyl)-4-(9-phenylcarbazol-4-yl)dibenzofuran-1-amine
CID 168847740
4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]dibenzofuran-1-amine
CID 168847918
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-4-phenyl-N-[4-(9-phenylcarbazol-4-yl)naphthalen-1-yl]dibenzofuran-1-amine
CID 168848110
4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168848086
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-4-phenyl-N-[4-(9-phenylcarbazol-4-yl)phenyl]dibenzofuran-1-amine
CID 168847677
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(2-naphthalen-1-ylphenyl)phenyl]phenyl]-4-phenyldibenzofuran-1-amine
CID 168848092
4-naphthalen-1-yl-N-phenanthren-3-yl-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-1-amine
CID 176820492
N-(4-naphthalen-1-ylphenyl)-N-[4-[2-(2-naphthalen-1-ylphenyl)phenyl]phenyl]-4-phenyldibenzofuran-1-amine
CID 168847848
4-(2-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 176608439
4-(3-carbazol-9-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 176609708
N-dibenzofuran-1-yl-9-phenyl-5-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010129
N-dibenzofuran-4-yl-5-naphthalen-1-yl-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009921

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine?
The IUPAC name of 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine (CID 168848073) is 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine.
What is the SMILES notation for 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine?
The canonical SMILES for 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine is c1ccc(-n2c3ccccc3c3c(-c4ccccc4-c4ccc(N(c5ccc(-c6ccc(-c7cccc8ccccc78)cc6)cc5)c5ccc(-c6cccc7ccccc67)c6oc7ccccc7c56)cc4)cccc32)cc1.
What is the InChIKey of 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine?
The InChIKey is WJGJSWLWNVFYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2O/c1-2-21-55(22-3-1)76-68-32-12-10-27-66(68)72-64(31-16-33-69(72)76)62-26-9-8-25-61(62)54-41-45-57(46-42-54)75(56-43-39-50(40-44-56)49-35-37-53(38-36-49)59-29-14-19-51-17-4-6-23-58(51)59)70-48-47-65(63-30-15-20-52-18-5-7-24-60(52)63)74-73(70)67-28-11-13-34-71(67)77-74/h1-48H.
What are the key properties of 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine?
4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine has a molecular weight of 981.21 g/mol, XLogP of 20.79, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(9-phenylcarbazol-4-yl)phenyl]phenyl]dibenzofuran-1-amine is sourced from PubChem (CID 168848073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).