N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine

C46H30N2O — CID 121343364

IUPACN-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(Nc5cccc6ccccc56)c(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1
InChIInChI=1S/C46H30N2O/c1-2-13-34(14-3-1)48-43-19-8-6-16-36(43)39-28-32(22-25-44(39)48)31-21-24-42(47-41-18-10-12-30-11-4-5-15-35(30)41)38(27-31)33-23-26-46-40(29-33)37-17-7-9-20-45(37)49-46/h1-29,47H
InChIKeyTUVGUMXWHGEJEV-UHFFFAOYSA-N
MW626.76 g/mol
LogP12.91
Rot. Bonds5

About N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine

N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine (PubChem CID 121343364) has the molecular formula C46H30N2O and a molecular weight of 626.76 g/mol. Its IUPAC name is N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
PubChem CID121343364
Molecular FormulaC46H30N2O
Molecular Weight626.76 g/mol
Exact Mass626.24
IUPAC NameN-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(Nc5cccc6ccccc56)c(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1
InChIInChI=1S/C46H30N2O/c1-2-13-34(14-3-1)48-43-19-8-6-16-36(43)39-28-32(22-25-44(39)48)31-21-24-42(47-41-18-10-12-30-11-4-5-15-35(30)41)38(27-31)33-23-26-46-40(29-33)37-17-7-9-20-45(37)49-46/h1-29,47H
InChIKeyTUVGUMXWHGEJEV-UHFFFAOYSA-N
XLogP12.91
TPSA30.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500626.76
LogP ≤ 512.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-dibenzofuran-2-ylphenyl)-9-phenylcarbazole
CID 139423478
3-(8,15-dioxatetracyclo[14.4.0.02,7.09,14]icosa-1(20),2(7),3,5,9,11,13,16,18-nonaen-4-yl)-9-phenylcarbazole
CID 145223329
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240
3-[4-dibenzofuran-2-yl-8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 118565404
3-[2-[(2-dibenzofuran-2-ylphenyl)methyl]phenyl]-9-phenylcarbazole
CID 145345371
9-[4-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-6-(3-dibenzofuran-2-ylcarbazol-9-yl)-1,3,5-triazin-2-yl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 126632674
3-dibenzofuran-2-yl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 129065119
3,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594554
9-phenyl-3-[3-[8-[3-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-yl]phenyl]carbazole
CID 163732904
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-[3-(3-dibenzofuran-2-ylphenyl)carbazol-9-yl]-9-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 123419299
3-dibenzofuran-1-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-2-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-3-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 163841517

Frequently Asked Questions

What is the IUPAC name of N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine?
The IUPAC name of N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine (CID 121343364) is N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine.
What is the SMILES notation for N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine?
The canonical SMILES for N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine is c1ccc(-n2c3ccccc3c3cc(-c4ccc(Nc5cccc6ccccc56)c(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1.
What is the InChIKey of N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine?
The InChIKey is TUVGUMXWHGEJEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2O/c1-2-13-34(14-3-1)48-43-19-8-6-16-36(43)39-28-32(22-25-44(39)48)31-21-24-42(47-41-18-10-12-30-11-4-5-15-35(30)41)38(27-31)33-23-26-46-40(29-33)37-17-7-9-20-45(37)49-46/h1-29,47H.
What are the key properties of N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine?
N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine has a molecular weight of 626.76 g/mol, XLogP of 12.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine is sourced from PubChem (CID 121343364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).