N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine

C46H30N2O — CID 176795601

IUPACN,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3oc4cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccccc5c4c23)cc1
InChIInChI=1S/C46H30N2O/c1-4-15-32(16-5-1)47(33-17-6-2-7-18-33)41-25-14-26-43-46(41)45-38-23-11-10-21-35(38)39(30-44(45)49-43)31-27-28-37-36-22-12-13-24-40(36)48(42(37)29-31)34-19-8-3-9-20-34/h1-30H
InChIKeyGTAXXAIYFMWDEI-UHFFFAOYSA-N
MW626.76 g/mol
LogP12.97
Rot. Bonds5

About N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine

N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine (PubChem CID 176795601) has the molecular formula C46H30N2O and a molecular weight of 626.76 g/mol. Its IUPAC name is N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine.

Molecular Properties

Compound NameN,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine
PubChem CID176795601
Molecular FormulaC46H30N2O
Molecular Weight626.76 g/mol
Exact Mass626.24
IUPAC NameN,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3oc4cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccccc5c4c23)cc1
InChIInChI=1S/C46H30N2O/c1-4-15-32(16-5-1)47(33-17-6-2-7-18-33)41-25-14-26-43-46(41)45-38-23-11-10-21-35(38)39(30-44(45)49-43)31-27-28-37-36-22-12-13-24-40(36)48(42(37)29-31)34-19-8-3-9-20-34/h1-30H
InChIKeyGTAXXAIYFMWDEI-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

Analyze N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-5-(9-phenylcarbazol-2-yl)-N-[4-(4-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-11-amine
CID 176795871
9-phenyl-N-(5-phenylnaphtho[2,1-b][1]benzofuran-11-yl)-N-(4-phenylphenyl)carbazol-2-amine
CID 176795732
N,N-diphenyl-5-(9-phenylcarbazol-4-yl)naphtho[2,1-b][1]benzofuran-11-amine
CID 176795724
5-(9-phenylcarbazol-1-yl)-N,N-bis(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 176795873
5-(9-phenylcarbazol-4-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 176795776
5-(9-phenylcarbazol-2-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-3-amine
CID 176765253
N-phenyl-9-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 129178935
5-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)-N-[(2-phenylphenyl)methyl]naphtho[2,1-b][1]benzofuran-11-amine
CID 176796146
N-dibenzofuran-1-yl-N-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)-9-phenylcarbazol-2-amine
CID 168814779
N-(4-naphtho[2,1-b][1]benzofuran-4-ylphenyl)-N,9-diphenylcarbazol-4-amine
CID 170034217
2-[3-(9-phenylcarbazol-2-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline
CID 118505760
N-naphtho[2,3-b][1]benzofuran-1-yl-N-(4-phenanthren-9-ylphenyl)-9-phenylcarbazol-2-amine
CID 167031787

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine?
The IUPAC name of N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine (CID 176795601) is N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine.
What is the SMILES notation for N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine?
The canonical SMILES for N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine is c1ccc(N(c2ccccc2)c2cccc3oc4cc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccccc5c4c23)cc1.
What is the InChIKey of N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine?
The InChIKey is GTAXXAIYFMWDEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2O/c1-4-15-32(16-5-1)47(33-17-6-2-7-18-33)41-25-14-26-43-46(41)45-38-23-11-10-21-35(38)39(30-44(45)49-43)31-27-28-37-36-22-12-13-24-40(36)48(42(37)29-31)34-19-8-3-9-20-34/h1-30H.
What are the key properties of N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine?
N,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-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,N-diphenyl-5-(9-phenylcarbazol-2-yl)naphtho[2,1-b][1]benzofuran-11-amine is sourced from PubChem (CID 176795601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).