N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine

C52H33NO2 — CID 170675155

IUPACN-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)oc4ccccc45)c4oc5c6ccccc6ccc5c4c3)cc2)cc1
InChIInChI=1S/C52H33NO2/c1-3-11-34(12-4-1)36-19-21-38(22-20-36)40-31-47-46-29-25-39-15-7-8-16-43(39)51(46)55-52(47)48(32-40)53(41-26-23-37(24-27-41)35-13-5-2-6-14-35)42-28-30-45-44-17-9-10-18-49(44)54-50(45)33-42/h1-33H
InChIKeyGYWMOTGVIZVYBV-UHFFFAOYSA-N
MW703.84 g/mol
LogP15.11
Rot. Bonds6

About N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine

N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine (PubChem CID 170675155) has the molecular formula C52H33NO2 and a molecular weight of 703.84 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
PubChem CID170675155
Molecular FormulaC52H33NO2
Molecular Weight703.84 g/mol
Exact Mass703.25
IUPAC NameN-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)oc4ccccc45)c4oc5c6ccccc6ccc5c4c3)cc2)cc1
InChIInChI=1S/C52H33NO2/c1-3-11-34(12-4-1)36-19-21-38(22-20-36)40-31-47-46-29-25-39-15-7-8-16-43(39)51(46)55-52(47)48(32-40)53(41-26-23-37(24-27-41)35-13-5-2-6-14-35)42-28-30-45-44-17-9-10-18-49(44)54-50(45)33-42/h1-33H
InChIKeyGYWMOTGVIZVYBV-UHFFFAOYSA-N
XLogP15.11
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.84
LogP ≤ 515.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-3-yl-N-[4-(4-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 168804045
N,8-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 170675105
N-(4-dibenzofuran-3-ylphenyl)-N-phenylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804046
N-(4-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-N-phenylnaphtho[1,2-b][1]benzofuran-9-amine
CID 176616609
N-dibenzofuran-3-yl-N,5-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 167402059
N-dibenzofuran-3-yl-5-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 167144400
N-[4-(4,6-diphenyldibenzofuran-2-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-3-amine
CID 148657680
N-dibenzofuran-3-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 121241788
N,8-bis(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)naphtho[1,2-b][1]benzofuran-10-amine
CID 170675516
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 168804037
N-dibenzofuran-3-yl-6-naphthalen-2-yl-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 167396499
N-dibenzofuran-3-yl-N-(4-phenylnaphthalen-1-yl)naphtho[1,2-b][1]benzofuran-10-amine
CID 168804139

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine?
The IUPAC name of N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine (CID 170675155) is N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine?
The canonical SMILES for N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine is c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)oc4ccccc45)c4oc5c6ccccc6ccc5c4c3)cc2)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine?
The InChIKey is GYWMOTGVIZVYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NO2/c1-3-11-34(12-4-1)36-19-21-38(22-20-36)40-31-47-46-29-25-39-15-7-8-16-43(39)51(46)55-52(47)48(32-40)53(41-26-23-37(24-27-41)35-13-5-2-6-14-35)42-28-30-45-44-17-9-10-18-49(44)54-50(45)33-42/h1-33H.
What are the key properties of N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine?
N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine has a molecular weight of 703.84 g/mol, XLogP of 15.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-N,8-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine is sourced from PubChem (CID 170675155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).