N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine

C60H40N2O — CID 168790807

IUPACN-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine
SMILESc1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2N(c2ccc(-c3cccc4oc5ccccc5c34)cc2)c2cccc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C60H40N2O/c1-4-19-41(20-5-1)46-25-10-11-26-49(46)58-47(42-21-6-2-7-22-42)29-16-32-53(58)62(45-39-37-43(38-40-45)48-30-17-36-57-59(48)51-28-13-15-35-56(51)63-57)55-34-18-33-54-60(55)50-27-12-14-31-52(50)61(54)44-23-8-3-9-24-44/h1-40H
InChIKeyJCOZWQDPXGWAPC-UHFFFAOYSA-N
MW804.99 g/mol
LogP16.82
Rot. Bonds8

About N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine

N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine (PubChem CID 168790807) has the molecular formula C60H40N2O and a molecular weight of 804.99 g/mol. Its IUPAC name is N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine
PubChem CID168790807
Molecular FormulaC60H40N2O
Molecular Weight804.99 g/mol
Exact Mass804.31
IUPAC NameN-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine
SMILESc1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2N(c2ccc(-c3cccc4oc5ccccc5c34)cc2)c2cccc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C60H40N2O/c1-4-19-41(20-5-1)46-25-10-11-26-49(46)58-47(42-21-6-2-7-22-42)29-16-32-53(58)62(45-39-37-43(38-40-45)48-30-17-36-57-59(48)51-28-13-15-35-56(51)63-57)55-34-18-33-54-60(55)50-27-12-14-31-52(50)61(54)44-23-8-3-9-24-44/h1-40H
InChIKeyJCOZWQDPXGWAPC-UHFFFAOYSA-N
XLogP16.82
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500804.99
LogP ≤ 516.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(9-phenylcarbazol-4-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 172500744
N-(4-dibenzofuran-3-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine
CID 168789749
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 168790977
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-2-(2-phenylphenyl)aniline
CID 155398224
3-dibenzofuran-1-yl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-2-(2-phenylphenyl)-N-(4-phenylphenyl)aniline
CID 170665542
N-(4-dibenzofuran-1-ylphenyl)-3-phenyl-2-(2-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]aniline
CID 168789602
N-(4-naphtho[2,1-b][1]benzofuran-4-ylphenyl)-N,9-diphenylcarbazol-4-amine
CID 170034217
N-(3-dibenzofuran-1-yl-2-phenylphenyl)-9-phenyl-N-(3-phenylphenyl)carbazol-4-amine
CID 170666069
N-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-2-dibenzofuran-1-yl-N-[2-(2-phenylphenyl)phenyl]aniline
CID 155398441
N-dibenzofuran-1-yl-9-phenyl-5-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010129
N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-1-ylphenyl)-2-phenylaniline
CID 155649255
N,3-diphenyl-N-[3-(9-phenylcarbazol-4-yl)phenyl]-2-(2-phenylphenyl)aniline
CID 168789242

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine?
The IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine (CID 168790807) is N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine.
What is the SMILES notation for N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine?
The canonical SMILES for N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine is c1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2N(c2ccc(-c3cccc4oc5ccccc5c34)cc2)c2cccc3c2c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine?
The InChIKey is JCOZWQDPXGWAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2O/c1-4-19-41(20-5-1)46-25-10-11-26-49(46)58-47(42-21-6-2-7-22-42)29-16-32-53(58)62(45-39-37-43(38-40-45)48-30-17-36-57-59(48)51-28-13-15-35-56(51)63-57)55-34-18-33-54-60(55)50-27-12-14-31-52(50)61(54)44-23-8-3-9-24-44/h1-40H.
What are the key properties of N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine?
N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine has a molecular weight of 804.99 g/mol, XLogP of 16.82, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-1-ylphenyl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-4-amine is sourced from PubChem (CID 168790807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).