N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine

C52H35NO — CID 168788465

IUPACN-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
SMILESc1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2-c2ccccc2N(c2ccc3ccccc3c2)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C52H35NO/c1-3-17-37(18-4-1)42-22-9-10-25-46(42)52-43(38-19-5-2-6-20-38)26-15-27-47(52)44-23-11-13-28-49(44)53(40-31-30-36-16-7-8-21-39(36)34-40)41-32-33-51-48(35-41)45-24-12-14-29-50(45)54-51/h1-35H
InChIKeyRZOBOCFHMXQQJT-UHFFFAOYSA-N
MW689.86 g/mol
LogP14.88
Rot. Bonds7

About N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine

N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine (PubChem CID 168788465) has the molecular formula C52H35NO and a molecular weight of 689.86 g/mol. Its IUPAC name is N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
PubChem CID168788465
Molecular FormulaC52H35NO
Molecular Weight689.86 g/mol
Exact Mass689.27
IUPAC NameN-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
SMILESc1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2-c2ccccc2N(c2ccc3ccccc3c2)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C52H35NO/c1-3-17-37(18-4-1)42-22-9-10-25-46(42)52-43(38-19-5-2-6-20-38)26-15-27-47(52)44-23-11-13-28-49(44)53(40-31-30-36-16-7-8-21-39(36)34-40)41-32-33-51-48(35-41)45-24-12-14-29-50(45)54-51/h1-35H
InChIKeyRZOBOCFHMXQQJT-UHFFFAOYSA-N
XLogP14.88
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500689.86
LogP ≤ 514.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-naphthalen-1-ylphenyl)-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
CID 168790250
N-naphthalen-1-yl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 168789935
N-naphthalen-2-yl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 172501948
N-naphthalen-1-yl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
CID 172503063
N-naphthalen-2-yl-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-1-amine
CID 172502233
N-(4-naphtho[2,1-b][1]benzofuran-4-ylphenyl)-N-(2-phenylphenyl)naphthalen-2-amine
CID 170031061
N-(4-naphthalen-2-ylphenyl)-N-[4-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168789792
N-(4-phenylphenyl)-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-3-amine
CID 168789991
N-(2-dibenzofuran-2-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 167326443
N-naphthalen-1-yl-N-[2-[2-[2-(4-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 172502268
N-(2-dibenzofuran-1-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-2-amine
CID 167324675
N-naphthalen-2-yl-N-(7-naphthalen-1-ylnaphthalen-1-yl)dibenzofuran-2-amine
CID 176588089

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine?
The IUPAC name of N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine (CID 168788465) is N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine.
What is the SMILES notation for N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine?
The canonical SMILES for N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine is c1ccc(-c2ccccc2-c2c(-c3ccccc3)cccc2-c2ccccc2N(c2ccc3ccccc3c2)c2ccc3oc4ccccc4c3c2)cc1.
What is the InChIKey of N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine?
The InChIKey is RZOBOCFHMXQQJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35NO/c1-3-17-37(18-4-1)42-22-9-10-25-46(42)52-43(38-19-5-2-6-20-38)26-15-27-47(52)44-23-11-13-28-49(44)53(40-31-30-36-16-7-8-21-39(36)34-40)41-32-33-51-48(35-41)45-24-12-14-29-50(45)54-51/h1-35H.
What are the key properties of N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine?
N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine has a molecular weight of 689.86 g/mol, XLogP of 14.88, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine is sourced from PubChem (CID 168788465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).