N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine

C46H30N2O — CID 167143326

IUPACN-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2cccc3c2oc2c4ccccc4c(N(c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1
InChIInChI=1S/C46H30N2O/c1-3-14-31(15-4-1)35-22-13-23-40-41-30-44(38-20-7-8-21-39(38)46(41)49-45(35)40)47(32-16-5-2-6-17-32)33-26-28-34(29-27-33)48-42-24-11-9-18-36(42)37-19-10-12-25-43(37)48/h1-30H
InChIKeyOWDUDYDOXGXXLW-UHFFFAOYSA-N
MW626.76 g/mol
LogP12.97
Rot. Bonds5

About N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine

N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine (PubChem CID 167143326) has the molecular formula C46H30N2O and a molecular weight of 626.76 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine
PubChem CID167143326
Molecular FormulaC46H30N2O
Molecular Weight626.76 g/mol
Exact Mass626.24
IUPAC NameN-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2cccc3c2oc2c4ccccc4c(N(c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1
InChIInChI=1S/C46H30N2O/c1-3-14-31(15-4-1)35-22-13-23-40-41-30-44(38-20-7-8-21-39(38)46(41)49-45(35)40)47(32-16-5-2-6-17-32)33-26-28-34(29-27-33)48-42-24-11-9-18-36(42)37-19-10-12-25-43(37)48/h1-30H
InChIKeyOWDUDYDOXGXXLW-UHFFFAOYSA-N
XLogP12.97
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500626.76
LogP ≤ 512.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-phenyl-N-(3-phenylphenyl)-N-[10-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-yl]carbazol-2-amine
CID 167143325
N-(4-phenanthren-9-ylphenyl)-10-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-5-amine
CID 167277934
N,N-diphenyl-4-[6-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]aniline
CID 90125795
N-[4-[6-(3-carbazol-9-ylphenyl)dibenzofuran-4-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90125897
N-[4-(2-carbazol-9-ylphenyl)phenyl]-2-(6-phenyldibenzofuran-4-yl)-N-(3-phenylphenyl)aniline
CID 139544676
4-[4-(N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylanilino)phenyl]-N,N-diphenylaniline
CID 58510633
N-(4-phenanthren-9-ylphenyl)-10-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-4-amine
CID 167277947
9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine
CID 170286483
N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-phenylphenyl)-9-[2-(4-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 164971651
N-(4-carbazol-9-ylphenyl)-4-(6-phenyldibenzofuran-2-yl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 168804257
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
N-[4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90207163

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine (CID 167143326) is N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine is c1ccc(-c2cccc3c2oc2c4ccccc4c(N(c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine?
The InChIKey is OWDUDYDOXGXXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2O/c1-3-14-31(15-4-1)35-22-13-23-40-41-30-44(38-20-7-8-21-39(38)46(41)49-45(35)40)47(32-16-5-2-6-17-32)33-26-28-34(29-27-33)48-42-24-11-9-18-36(42)37-19-10-12-25-43(37)48/h1-30H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine?
N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine has a molecular weight of 626.76 g/mol, XLogP of 12.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine is sourced from PubChem (CID 167143326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).