N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine

C50H31NO2 — CID 177130873

IUPACN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc3c(ccc4oc5ccc(N(c6ccc(-c7ccc8ccccc8c7)cc6)c6ccc7oc8ccccc8c7c6)cc5c43)c2)cc1
InChIInChI=1S/C50H31NO2/c1-2-8-32(9-3-1)37-18-24-42-38(29-37)19-25-49-50(42)45-31-41(23-27-48(45)53-49)51(40-22-26-47-44(30-40)43-12-6-7-13-46(43)52-47)39-20-16-34(17-21-39)36-15-14-33-10-4-5-11-35(33)28-36/h1-31H
InChIKeyBKLKZAREQPEGPA-UHFFFAOYSA-N
MW677.80 g/mol
LogP14.60
Rot. Bonds5

About N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine

N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine (PubChem CID 177130873) has the molecular formula C50H31NO2 and a molecular weight of 677.80 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine
PubChem CID177130873
Molecular FormulaC50H31NO2
Molecular Weight677.80 g/mol
Exact Mass677.24
IUPAC NameN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc3c(ccc4oc5ccc(N(c6ccc(-c7ccc8ccccc8c7)cc6)c6ccc7oc8ccccc8c7c6)cc5c43)c2)cc1
InChIInChI=1S/C50H31NO2/c1-2-8-32(9-3-1)37-18-24-42-38(29-37)19-25-49-50(42)45-31-41(23-27-48(45)53-49)51(40-22-26-47-44(30-40)43-12-6-7-13-46(43)52-47)39-20-16-34(17-21-39)36-15-14-33-10-4-5-11-35(33)28-36/h1-31H
InChIKeyBKLKZAREQPEGPA-UHFFFAOYSA-N
XLogP14.60
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500677.80
LogP ≤ 514.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine with MolForge

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Related Compounds

N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-2-amine
CID 170030394
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 121325434
3-naphthalen-2-yl-N-(4-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-N-(4-phenylphenyl)aniline
CID 170030567
8-N-dibenzofuran-3-yl-8-N-(4-naphthalen-2-ylphenyl)-2-N,2-N-diphenyldibenzofuran-2,8-diamine
CID 146576029
N-(4-dibenzofuran-3-ylphenyl)-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]dibenzofuran-2-amine
CID 166565962
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-phenyldibenzofuran-2-amine
CID 174256821
N-(4-naphthalen-2-ylphenyl)-N-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-4-phenylaniline
CID 170031307
N-(4-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)naphtho[2,1-b][1]benzofuran-2-amine
CID 170030395
N-[3-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-2-amine
CID 174256841
N-chrysen-3-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 170130661
3-dibenzofuran-2-yl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline
CID 170535051
N-(6-naphthalen-2-ylnaphthalen-2-yl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 176587573

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine?
The IUPAC name of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine (CID 177130873) is N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine?
The canonical SMILES for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine is c1ccc(-c2ccc3c(ccc4oc5ccc(N(c6ccc(-c7ccc8ccccc8c7)cc6)c6ccc7oc8ccccc8c7c6)cc5c43)c2)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine?
The InChIKey is BKLKZAREQPEGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H31NO2/c1-2-8-32(9-3-1)37-18-24-42-38(29-37)19-25-49-50(42)45-31-41(23-27-48(45)53-49)51(40-22-26-47-44(30-40)43-12-6-7-13-46(43)52-47)39-20-16-34(17-21-39)36-15-14-33-10-4-5-11-35(33)28-36/h1-31H.
What are the key properties of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine?
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine has a molecular weight of 677.80 g/mol, XLogP of 14.60, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-3-phenylnaphtho[2,1-b][1]benzofuran-10-amine is sourced from PubChem (CID 177130873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).