N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine

C34H22FNO — CID 171763443

IUPACN-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine
SMILESFc1cccc(-c2cccc3cccc(-c4cccc(Nc5ccc6oc7ccccc7c6c5)c4)c23)c1
InChIInChI=1S/C34H22FNO/c35-25-11-3-9-23(19-25)28-14-5-7-22-8-6-15-29(34(22)28)24-10-4-12-26(20-24)36-27-17-18-33-31(21-27)30-13-1-2-16-32(30)37-33/h1-21,36H
InChIKeyIONISXWCEOEITL-UHFFFAOYSA-N
MW479.55 g/mol
LogP9.96
Rot. Bonds4

About N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine

N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine (PubChem CID 171763443) has the molecular formula C34H22FNO and a molecular weight of 479.55 g/mol. Its IUPAC name is N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine.

Molecular Properties

Compound NameN-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine
PubChem CID171763443
Molecular FormulaC34H22FNO
Molecular Weight479.55 g/mol
Exact Mass479.17
IUPAC NameN-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine
SMILESFc1cccc(-c2cccc3cccc(-c4cccc(Nc5ccc6oc7ccccc7c6c5)c4)c23)c1
InChIInChI=1S/C34H22FNO/c35-25-11-3-9-23(19-25)28-14-5-7-22-8-6-15-29(34(22)28)24-10-4-12-26(20-24)36-27-17-18-33-31(21-27)30-13-1-2-16-32(30)37-33/h1-21,36H
InChIKeyIONISXWCEOEITL-UHFFFAOYSA-N
XLogP9.96
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.55
LogP ≤ 59.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170108986
N-(3-dibenzofuran-1-ylphenyl)-2-(8-phenylnaphthalen-1-yl)aniline
CID 170298496
N-dibenzofuran-3-yl-9-phenanthren-3-yldibenzofuran-2-amine
CID 169315832
2-[4-[4-(3-fluorophenyl)phenyl]phenyl]dibenzofuran
CID 171056558
N-(3-dibenzofuran-1-ylphenyl)-9-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 166775546
N-(3-dibenzofuran-2-ylphenyl)-2-phenylaniline
CID 121360316
N-(3-dibenzofuran-4-ylphenyl)-9-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 166775445
N-dibenzofuran-1-yldibenzofuran-2-amine
CID 164743454
N,9-diphenyldibenzofuran-3-amine
CID 156790002
N-dibenzofuran-2-yldibenzofuran-3-amine;ethane
CID 145077285
4-dibenzofuran-2-yl-N,3-bis(4-phenylphenyl)aniline
CID 164934515
1-(3-dibenzofuran-1-ylphenyl)dibenzofuran
CID 170213719

Frequently Asked Questions

What is the IUPAC name of N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine?
The IUPAC name of N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine (CID 171763443) is N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine.
What is the SMILES notation for N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine?
The canonical SMILES for N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine is Fc1cccc(-c2cccc3cccc(-c4cccc(Nc5ccc6oc7ccccc7c6c5)c4)c23)c1.
What is the InChIKey of N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine?
The InChIKey is IONISXWCEOEITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22FNO/c35-25-11-3-9-23(19-25)28-14-5-7-22-8-6-15-29(34(22)28)24-10-4-12-26(20-24)36-27-17-18-33-31(21-27)30-13-1-2-16-32(30)37-33/h1-21,36H.
What are the key properties of N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine?
N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine has a molecular weight of 479.55 g/mol, XLogP of 9.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[8-(3-fluorophenyl)naphthalen-1-yl]phenyl]dibenzofuran-2-amine is sourced from PubChem (CID 171763443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).