N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine

C30H19NO2 — CID 162366598

IUPACN-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine
SMILESc1ccc2oc(-c3ccc4cc(Nc5ccc6oc7ccccc7c6c5)ccc4c3)cc2c1
InChIInChI=1S/C30H19NO2/c1-3-7-27-21(5-1)17-30(32-27)22-10-9-20-16-23(12-11-19(20)15-22)31-24-13-14-29-26(18-24)25-6-2-4-8-28(25)33-29/h1-18,31H
InChIKeyFZLSSURSUUTSGM-UHFFFAOYSA-N
MW425.49 g/mol
LogP8.90
Rot. Bonds3

About N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine

N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine (PubChem CID 162366598) has the molecular formula C30H19NO2 and a molecular weight of 425.49 g/mol. Its IUPAC name is N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine.

Molecular Properties

Compound NameN-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine
PubChem CID162366598
Molecular FormulaC30H19NO2
Molecular Weight425.49 g/mol
Exact Mass425.14
IUPAC NameN-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine
SMILESc1ccc2oc(-c3ccc4cc(Nc5ccc6oc7ccccc7c6c5)ccc4c3)cc2c1
InChIInChI=1S/C30H19NO2/c1-3-7-27-21(5-1)17-30(32-27)22-10-9-20-16-23(12-11-19(20)15-22)31-24-13-14-29-26(18-24)25-6-2-4-8-28(25)33-29/h1-18,31H
InChIKeyFZLSSURSUUTSGM-UHFFFAOYSA-N
XLogP8.90
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.49
LogP ≤ 58.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine
CID 118616145
N-dibenzofuran-2-yldibenzofuran-3-amine;ethane
CID 145077285
N-dibenzofuran-3-yl-9-phenanthren-3-yldibenzofuran-2-amine
CID 169315832
3-naphthalen-2-yldibenzofuran
CID 68932481
7-N,19-N-bis[6-(1-benzofuran-2-yl)naphthalen-2-yl]-7-N,19-N-diphenyl-10,16-dioxahexacyclo[11.11.0.03,11.04,9.015,23.017,22]tetracosa-1,3(11),4(9),5,7,12,14,17(22),18,20,23-undecaene-7,19-diamine
CID 134560112
8-(1-benzofuran-2-yl)-N-[4-[4-(N-[8-(1-benzofuran-2-yl)dibenzofuran-2-yl]anilino)phenyl]phenyl]-N-phenyldibenzofuran-2-amine
CID 89295907
N-[4-[2,6-di(propan-2-yl)phenyl]phenyl]-9-naphthalen-2-yldibenzofuran-2-amine
CID 176760069
2-[6-(6-phenanthren-9-ylnaphthalen-2-yl)naphthalen-2-yl]dibenzofuran
CID 58569083
2-dibenzofuran-2-yl-4-naphthalen-2-yl-6-naphtho[2,3-b][1]benzofuran-2-yl-1,3,5-triazine
CID 158181891
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-2-ylaniline
CID 155374295
2-[4-[6-(4-fluorophenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 169293505
N-dibenzofuran-1-yldibenzofuran-2-amine
CID 164743454

Frequently Asked Questions

What is the IUPAC name of N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine?
The IUPAC name of N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine (CID 162366598) is N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine.
What is the SMILES notation for N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine?
The canonical SMILES for N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine is c1ccc2oc(-c3ccc4cc(Nc5ccc6oc7ccccc7c6c5)ccc4c3)cc2c1.
What is the InChIKey of N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine?
The InChIKey is FZLSSURSUUTSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19NO2/c1-3-7-27-21(5-1)17-30(32-27)22-10-9-20-16-23(12-11-19(20)15-22)31-24-13-14-29-26(18-24)25-6-2-4-8-28(25)33-29/h1-18,31H.
What are the key properties of N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine?
N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine has a molecular weight of 425.49 g/mol, XLogP of 8.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine is sourced from PubChem (CID 162366598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).