4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine

C42H28N2O — CID 176609874

IUPAC4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(oc4ccccc43)c2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-36-35-19-9-12-22-40(35)45-42(36)41(39)29-23-25-32(26-24-29)44-37-20-10-7-17-33(37)34-18-8-11-21-38(34)44/h1-28H
InChIKeyBZCOMRCUXCZHSM-UHFFFAOYSA-N
MW576.70 g/mol
LogP11.82
Rot. Bonds5

About 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine

4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine (PubChem CID 176609874) 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-3-amine.

Molecular Properties

Compound Name4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine
PubChem CID176609874
Molecular FormulaC42H28N2O
Molecular Weight576.70 g/mol
Exact Mass576.22
IUPAC Name4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(oc4ccccc43)c2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-36-35-19-9-12-22-40(35)45-42(36)41(39)29-23-25-32(26-24-29)44-37-20-10-7-17-33(37)34-18-8-11-21-38(34)44/h1-28H
InChIKeyBZCOMRCUXCZHSM-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-(3-phenanthren-2-ylphenyl)-N-phenyldibenzofuran-3-amine
CID 176608220
4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 176608752
N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 135277344
4-phenyl-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine
CID 135277582
4-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)-N-naphthalen-1-yldibenzofuran-3-amine
CID 176608424
4-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-3-amine
CID 176608527
4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-1-amine
CID 176608271
4-(4-carbazol-9-ylphenyl)-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]dibenzofuran-3-amine
CID 176608256
4-(4-carbazol-9-ylphenyl)-N-[2,3,5,6-tetradeuterio-4-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]dibenzofuran-3-amine
CID 176608970
4-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)-N-naphthalen-1-yldibenzofuran-3-amine
CID 176608726
4-[4-(N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylanilino)phenyl]-N,N-diphenylaniline
CID 58510633
N-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-N,4-diphenylaniline
CID 130230934

Frequently Asked Questions

What is the IUPAC name of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine?
The IUPAC name of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine (CID 176609874) is 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine.
What is the SMILES notation for 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine?
The canonical SMILES for 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine is c1ccc(N(c2ccccc2)c2ccc3c(oc4ccccc43)c2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine?
The InChIKey is BZCOMRCUXCZHSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2O/c1-3-13-30(14-4-1)43(31-15-5-2-6-16-31)39-28-27-36-35-19-9-12-22-40(35)45-42(36)41(39)29-23-25-32(26-24-29)44-37-20-10-7-17-33(37)34-18-8-11-21-38(34)44/h1-28H.
What are the key properties of 4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine?
4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-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-3-amine is sourced from PubChem (CID 176609874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).