N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine

C40H23NO3 — CID 168804115

IUPACN,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine
SMILESc1ccc2c(c1)ccc1c3cccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5oc6ccccc6c5c4)c3oc21
InChIInChI=1S/C40H23NO3/c1-2-9-27-24(8-1)16-19-31-30-12-7-13-34(40(30)44-39(27)31)41(25-17-20-37-32(22-25)28-10-3-5-14-35(28)42-37)26-18-21-38-33(23-26)29-11-4-6-15-36(29)43-38/h1-23H
InChIKeyIXGQOKXRQOESGJ-UHFFFAOYSA-N
MW565.63 g/mol
LogP12.01
Rot. Bonds3

About N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine

N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine (PubChem CID 168804115) has the molecular formula C40H23NO3 and a molecular weight of 565.63 g/mol. Its IUPAC name is N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine.

Molecular Properties

Compound NameN,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine
PubChem CID168804115
Molecular FormulaC40H23NO3
Molecular Weight565.63 g/mol
Exact Mass565.17
IUPAC NameN,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine
SMILESc1ccc2c(c1)ccc1c3cccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5oc6ccccc6c5c4)c3oc21
InChIInChI=1S/C40H23NO3/c1-2-9-27-24(8-1)16-19-31-30-12-7-13-34(40(30)44-39(27)31)41(25-17-20-37-32(22-25)28-10-3-5-14-35(28)42-37)26-18-21-38-33(23-26)29-11-4-6-15-36(29)43-38/h1-23H
InChIKeyIXGQOKXRQOESGJ-UHFFFAOYSA-N
XLogP12.01
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500565.63
LogP ≤ 512.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-dibenzofuran-2-yl-N-phenanthren-9-ylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804116
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-N-[4-(4-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 168804045
N,N-di(dibenzofuran-4-yl)naphtho[1,2-b][1]benzofuran-10-amine
CID 168804104
N-(4-dibenzofuran-3-ylphenyl)-N-phenylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804046
6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine
CID 167208512
N,N-dinaphthalen-1-ylnaphtho[1,2-b][1]benzofuran-2-amine
CID 167277467
N-(4-dibenzofuran-2-ylphenyl)-N-phenanthren-3-yl-8-phenyldibenzofuran-4-amine
CID 168809994
N-chrysen-1-yl-N-phenylnaphtho[1,2-b][1]benzofuran-8-amine
CID 170140586
N-dibenzofuran-3-yl-N-triphenylen-2-yldibenzofuran-4-amine
CID 166845761
N-(4-naphthalen-1-ylphenyl)-N-(2-naphtho[1,2-b][1]benzofuran-8-ylphenyl)dibenzofuran-2-amine
CID 174280847
N-dibenzofuran-1-yl-N-dibenzothiophen-3-ylnaphtho[1,2-b][1]benzofuran-10-amine
CID 177122312

Frequently Asked Questions

What is the IUPAC name of N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine?
The IUPAC name of N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine (CID 168804115) is N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine.
What is the SMILES notation for N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine?
The canonical SMILES for N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine is c1ccc2c(c1)ccc1c3cccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5oc6ccccc6c5c4)c3oc21.
What is the InChIKey of N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine?
The InChIKey is IXGQOKXRQOESGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H23NO3/c1-2-9-27-24(8-1)16-19-31-30-12-7-13-34(40(30)44-39(27)31)41(25-17-20-37-32(22-25)28-10-3-5-14-35(28)42-37)26-18-21-38-33(23-26)29-11-4-6-15-36(29)43-38/h1-23H.
What are the key properties of N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine?
N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine has a molecular weight of 565.63 g/mol, XLogP of 12.01, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(dibenzofuran-2-yl)naphtho[1,2-b][1]benzofuran-10-amine is sourced from PubChem (CID 168804115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).