2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine

C42H28N2O — CID 156521402

IUPAC2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2cccc(N(c3ccccc3)c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3ccccc34)c2)cc1
InChIInChI=1S/C42H28N2O/c1-3-14-29(15-4-1)30-16-13-19-32(26-30)43(31-17-5-2-6-18-31)40-28-33(27-37-36-22-9-12-25-41(36)45-42(37)40)44-38-23-10-7-20-34(38)35-21-8-11-24-39(35)44/h1-28H
InChIKeySNKYTJWPGUYJTO-UHFFFAOYSA-N
MW576.70 g/mol
LogP11.82
Rot. Bonds5

About 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine

2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine (PubChem CID 156521402) has the molecular formula C42H28N2O and a molecular weight of 576.70 g/mol. Its IUPAC name is 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound Name2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine
PubChem CID156521402
Molecular FormulaC42H28N2O
Molecular Weight576.70 g/mol
Exact Mass576.22
IUPAC Name2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2cccc(N(c3ccccc3)c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3ccccc34)c2)cc1
InChIInChI=1S/C42H28N2O/c1-3-14-29(15-4-1)30-16-13-19-32(26-30)43(31-17-5-2-6-18-31)40-28-33(27-37-36-22-9-12-25-41(36)45-42(37)40)44-38-23-10-7-20-34(38)35-21-8-11-24-39(35)44/h1-28H
InChIKeySNKYTJWPGUYJTO-UHFFFAOYSA-N
XLogP11.82
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500576.70
LogP ≤ 511.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 168809217
N-(9,9-dimethylfluoren-2-yl)-2-(2-phenylcarbazol-9-yl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 156521417
N,4-diphenyl-N-[4-[2-(2-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenyl]aniline
CID 156521426
N-[3-[4-[3-(N-dibenzofuran-4-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-4-amine
CID 71126918
9-dibenzofuran-2-yl-N-phenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 118333380
1-N,3-N-di(dibenzofuran-4-yl)-1-N,3-N-diphenyl-5-(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 131997540
N-[3-(3-carbazol-9-ylphenyl)phenyl]-N-(2-phenylphenyl)dibenzofuran-4-amine
CID 167086378
N-naphtho[2,1-b][1]benzofuran-6-yl-9-phenyl-N-(3-phenylphenyl)carbazol-3-amine
CID 170034060
N-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 90262621
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 167278242
N-dibenzofuran-4-yl-N-(4-dibenzofuran-3-ylphenyl)-9-phenylcarbazol-2-amine
CID 168814340
N-(3-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-3-phenylaniline
CID 153314771

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine?
The IUPAC name of 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine (CID 156521402) is 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine?
The canonical SMILES for 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine is c1ccc(-c2cccc(N(c3ccccc3)c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3ccccc34)c2)cc1.
What is the InChIKey of 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine?
The InChIKey is SNKYTJWPGUYJTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2O/c1-3-14-29(15-4-1)30-16-13-19-32(26-30)43(31-17-5-2-6-18-31)40-28-33(27-37-36-22-9-12-25-41(36)45-42(37)40)44-38-23-10-7-20-34(38)35-21-8-11-24-39(35)44/h1-28H.
What are the key properties of 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine?
2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine has a molecular weight of 576.70 g/mol, XLogP of 11.82, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 156521402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).