N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine

C65H42N2O — CID 167334161

IUPACN-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4oc5ccc6ccccc6c5c4c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C65H42N2O/c1-4-16-43(17-5-1)44-28-32-49(33-29-44)66(51-35-39-62-57(42-51)64-52-23-11-10-18-45(52)30-38-63(64)68-62)50-34-37-61-56(41-50)55-40-47(31-36-60(55)67(61)48-21-8-3-9-22-48)65(46-19-6-2-7-20-46)58-26-14-12-24-53(58)54-25-13-15-27-59(54)65/h1-42H
InChIKeyPSGDJTUPUNIBCL-UHFFFAOYSA-N
MW867.06 g/mol
LogP17.34
Rot. Bonds7

About N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine

N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 167334161) has the molecular formula C65H42N2O and a molecular weight of 867.06 g/mol. Its IUPAC name is N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound NameN-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID167334161
Molecular FormulaC65H42N2O
Molecular Weight867.06 g/mol
Exact Mass866.33
IUPAC NameN-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4oc5ccc6ccccc6c5c4c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C65H42N2O/c1-4-16-43(17-5-1)44-28-32-49(33-29-44)66(51-35-39-62-57(42-51)64-52-23-11-10-18-45(52)30-38-63(64)68-62)50-34-37-61-56(41-50)55-40-47(31-36-60(55)67(61)48-21-8-3-9-22-48)65(46-19-6-2-7-20-46)58-26-14-12-24-53(58)54-25-13-15-27-59(54)65/h1-42H
InChIKeyPSGDJTUPUNIBCL-UHFFFAOYSA-N
XLogP17.34
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500867.06
LogP ≤ 517.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 163745971
9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 129264403
9-phenyl-6-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-3-amine
CID 167214978
N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]dibenzofuran-2-amine
CID 167214769
9-phenyl-7-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)carbazol-3-amine
CID 167334078
N-(7,7-dimethylbenzo[g]fluoren-9-yl)-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine
CID 167334048
N-naphthalen-1-yl-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]naphthalen-1-amine
CID 167215207
N,9-diphenyl-9-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)fluoren-2-amine
CID 122593307
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 167214675
N-(9,9-diphenylfluoren-2-yl)-N-[4-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 89426453
4-phenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-yl]phenyl]aniline
CID 167334212
9,9-diphenyl-N-[4-(7-phenylbenzo[c]carbazol-10-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 118282644

Frequently Asked Questions

What is the IUPAC name of N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine (CID 167334161) is N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine is c1ccc(-c2ccc(N(c3ccc4oc5ccc6ccccc6c5c4c3)c3ccc4c(c3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3n4-c3ccccc3)cc2)cc1.
What is the InChIKey of N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is PSGDJTUPUNIBCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H42N2O/c1-4-16-43(17-5-1)44-28-32-49(33-29-44)66(51-35-39-62-57(42-51)64-52-23-11-10-18-45(52)30-38-63(64)68-62)50-34-37-61-56(41-50)55-40-47(31-36-60(55)67(61)48-21-8-3-9-22-48)65(46-19-6-2-7-20-46)58-26-14-12-24-53(58)54-25-13-15-27-59(54)65/h1-42H.
What are the key properties of N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine?
N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 867.06 g/mol, XLogP of 17.34, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-6-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 167334161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).