N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine

C52H32N2O2 — CID 171739377

IUPACN-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3oc4c5ccccc5ccc4c23)c(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C52H32N2O2/c1-2-14-36-33(13-1)27-32-43-50-47(24-12-26-49(50)56-51(36)43)54(35-30-28-34(29-31-35)53-44-21-7-3-15-37(44)38-16-4-8-22-45(38)53)46-23-9-5-17-39(46)41-19-11-20-42-40-18-6-10-25-48(40)55-52(41)42/h1-32H
InChIKeyTWUSKKCTKPFWPT-UHFFFAOYSA-N
MW716.84 g/mol
LogP14.87
Rot. Bonds5

About N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine

N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine (PubChem CID 171739377) has the molecular formula C52H32N2O2 and a molecular weight of 716.84 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
PubChem CID171739377
Molecular FormulaC52H32N2O2
Molecular Weight716.84 g/mol
Exact Mass716.25
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3oc4c5ccccc5ccc4c23)c(-c2cccc3c2oc2ccccc23)c1
InChIInChI=1S/C52H32N2O2/c1-2-14-36-33(13-1)27-32-43-50-47(24-12-26-49(50)56-51(36)43)54(35-30-28-34(29-31-35)53-44-21-7-3-15-37(44)38-16-4-8-22-45(38)53)46-23-9-5-17-39(46)41-19-11-20-42-40-18-6-10-25-48(40)55-52(41)42/h1-32H
InChIKeyTWUSKKCTKPFWPT-UHFFFAOYSA-N
XLogP14.87
TPSA34.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500716.84
LogP ≤ 514.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-carbazol-9-ylphenyl)-N-(2-naphtho[1,2-b][1]benzofuran-7-ylphenyl)naphthalen-1-amine
CID 167329843
N-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
CID 171737618
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(2-dibenzofuran-4-ylphenyl)dibenzofuran-1-amine
CID 164822786
N-(2-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine
CID 171738406
N-(4-carbazol-9-ylphenyl)-N-phenanthren-9-ylnaphtho[1,2-b][1]benzofuran-7-amine
CID 167277077
N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-2-naphtho[1,2-b][1]benzofuran-7-ylaniline
CID 167329361
4-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-3-amine
CID 176608527
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(2-dibenzofuran-4-ylphenyl)-2-phenylaniline
CID 164822828
N-dibenzofuran-4-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171737323
N-naphtho[1,2-b][1]benzofuran-7-yl-N,9-diphenylcarbazol-2-amine
CID 171738403
N-(4-dibenzofuran-1-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738867
N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171737568

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine (CID 171739377) is N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine is c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3oc4c5ccccc5ccc4c23)c(-c2cccc3c2oc2ccccc23)c1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine?
The InChIKey is TWUSKKCTKPFWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N2O2/c1-2-14-36-33(13-1)27-32-43-50-47(24-12-26-49(50)56-51(36)43)54(35-30-28-34(29-31-35)53-44-21-7-3-15-37(44)38-16-4-8-22-45(38)53)46-23-9-5-17-39(46)41-19-11-20-42-40-18-6-10-25-48(40)55-52(41)42/h1-32H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine?
N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine has a molecular weight of 716.84 g/mol, XLogP of 14.87, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-4-ylphenyl)naphtho[1,2-b][1]benzofuran-7-amine is sourced from PubChem (CID 171739377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).