4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine

C42H28N2O — CID 176608271

IUPAC4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine
SMILESc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-33(42-41(39)36-19-9-12-22-40(36)45-42)29-23-25-32(26-24-29)44-37-20-10-7-17-34(37)35-18-8-11-21-38(35)44/h1-28H
InChIKeyIHRKKVSRTLDKGE-UHFFFAOYSA-N
MW576.70 g/mol
LogP11.82
Rot. Bonds5

About 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine

4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine (PubChem CID 176608271) has the molecular formula C42H28N2O and a molecular weight of 576.70 g/mol. Its IUPAC name is 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine.

Molecular Properties

Compound Name4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine
PubChem CID176608271
Molecular FormulaC42H28N2O
Molecular Weight576.70 g/mol
Exact Mass576.22
IUPAC Name4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine
SMILESc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-33(42-41(39)36-19-9-12-22-40(36)45-42)29-23-25-32(26-24-29)44-37-20-10-7-17-34(37)35-18-8-11-21-38(35)44/h1-28H
InChIKeyIHRKKVSRTLDKGE-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

4-(4-carbazol-9-ylphenyl)-N-(4-phenanthren-2-ylphenyl)-N-phenyldibenzofuran-1-amine
CID 176609511
4-(4-carbazol-9-ylphenyl)-N-(2,6-dimethyl-4-phenylphenyl)-N-phenyldibenzofuran-1-amine
CID 176609428
4-(4-carbazol-9-ylphenyl)-N-(3-phenanthren-9-ylphenyl)-N-phenyldibenzofuran-1-amine
CID 176608684
4-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-N-naphthalen-2-yldibenzofuran-1-amine
CID 176608048
N-[4-(4-carbazol-9-ylphenyl)phenyl]-2-phenyl-N-[3-(4-phenyldibenzofuran-1-yl)phenyl]aniline
CID 155398470
4-[4-(N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylanilino)phenyl]-N,N-diphenylaniline
CID 58510633
N-phenanthren-3-yl-9-phenyl-N-[4-(4-phenylphenyl)dibenzofuran-1-yl]carbazol-3-amine
CID 176820826
4-(4-carbazol-9-ylphenyl)-N-(2-methylphenyl)-N-(3-methyl-4-phenylphenyl)dibenzofuran-1-amine
CID 176609442
4-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-N-phenyldibenzothiophen-1-amine
CID 176608553
4-(4-carbazol-9-ylphenyl)-N-(2,4-diphenylphenyl)-N-(3-methyl-4-phenylphenyl)dibenzofuran-1-amine
CID 176608299
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]dibenzofuran-1-amine
CID 168847918

Frequently Asked Questions

What is the IUPAC name of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine?
The IUPAC name of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine (CID 176608271) is 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine.
What is the SMILES notation for 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine?
The canonical SMILES for 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine is c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3oc4ccccc4c23)cc1.
What is the InChIKey of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine?
The InChIKey is IHRKKVSRTLDKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-33(42-41(39)36-19-9-12-22-40(36)45-42)29-23-25-32(26-24-29)44-37-20-10-7-17-34(37)35-18-8-11-21-38(35)44/h1-28H.
What are the key properties of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine?
4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-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 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine is sourced from PubChem (CID 176608271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).