6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine

C42H28N2O2 — CID 167208512

IUPAC6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine
SMILESc1ccc(N(c2ccccc2)c2ccc3oc4c(N(c5ccccc5)c5ccc6oc7ccccc7c6c5)cccc4c3c2)cc1
InChIInChI=1S/C42H28N2O2/c1-4-13-29(14-5-1)43(30-15-6-2-7-16-30)32-23-26-41-37(27-32)35-20-12-21-38(42(35)46-41)44(31-17-8-3-9-18-31)33-24-25-40-36(28-33)34-19-10-11-22-39(34)45-40/h1-28H
InChIKeyMEMYXKLWIDJFPC-UHFFFAOYSA-N
MW592.70 g/mol
LogP12.43
Rot. Bonds6

About 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine

6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine (PubChem CID 167208512) has the molecular formula C42H28N2O2 and a molecular weight of 592.70 g/mol. Its IUPAC name is 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine.

Molecular Properties

Compound Name6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine
PubChem CID167208512
Molecular FormulaC42H28N2O2
Molecular Weight592.70 g/mol
Exact Mass592.22
IUPAC Name6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine
SMILESc1ccc(N(c2ccccc2)c2ccc3oc4c(N(c5ccccc5)c5ccc6oc7ccccc7c6c5)cccc4c3c2)cc1
InChIInChI=1S/C42H28N2O2/c1-4-13-29(14-5-1)43(30-15-6-2-7-16-30)32-23-26-41-37(27-32)35-20-12-21-38(42(35)46-41)44(31-17-8-3-9-18-31)33-24-25-40-36(28-33)34-19-10-11-22-39(34)45-40/h1-28H
InChIKeyMEMYXKLWIDJFPC-UHFFFAOYSA-N
XLogP12.43
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500592.70
LogP ≤ 512.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine with MolForge

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Related Compounds

N-[4-[4-[dibenzofuran-4-yl(naphthalen-1-yl)amino]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-4-amine;N-naphthalen-1-yl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]dibenzofuran-2-amine;N-naphthalen-1-yl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]dibenzofuran-4-amine;N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 157350429
3-N-dibenzofuran-4-yl-3-N-(4-dibenzofuran-2-ylphenyl)-1-N,1-N,5-N,5-N-tetraphenylbenzene-1,3,5-triamine
CID 139393694
7-N-(1-chlorodibenzofuran-3-yl)-2-N-dibenzofuran-4-yl-2-N,7-N-diphenyldibenzofuran-2,7-diamine
CID 146551038
6-N,18-N-di(dibenzofuran-4-yl)-6-N,18-N-diphenyl-3,15-dioxahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16(21),17,19,23-undecaene-6,18-diamine
CID 162475564
N-dibenzofuran-4-yl-N-phenyl-10,22-dioxahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4(9),5,7,11,13,15(23),16,18,20-undecaen-7-amine
CID 162475643
N,N-diphenyldibenzofuran-2-amine
CID 58038469
N-dibenzofuran-2-yl-N-(4-dibenzofuran-4-ylphenyl)-6-phenyldibenzofuran-4-amine
CID 167397725
9-N,25-N-di(dibenzofuran-4-yl)-9-N,25-N-diphenyl-14,20-dioxaoctacyclo[15.15.0.03,15.04,13.06,11.019,31.021,30.023,28]dotriaconta-1,3(15),4(13),5,7,9,11,16,18,21(30),22,24,26,28,31-pentadecaene-9,25-diamine
CID 146497471
4-N,6-N-diphenyl-4-N-[8-(N-phenylanilino)dibenzofuran-2-yl]-6-N-[8-(N-phenylanilino)dibenzothiophen-2-yl]dibenzofuran-4,6-diamine
CID 145264520
N-dibenzofuran-3-yl-N-triphenylen-2-yldibenzofuran-4-amine
CID 166845761
N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 71126595
1-N-dibenzofuran-2-yl-3-N-dibenzofuran-4-yl-5-phenanthren-9-yl-1-N,3-N-diphenylbenzene-1,3-diamine
CID 162770482

Frequently Asked Questions

What is the IUPAC name of 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine?
The IUPAC name of 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine (CID 167208512) is 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine.
What is the SMILES notation for 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine?
The canonical SMILES for 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine is c1ccc(N(c2ccccc2)c2ccc3oc4c(N(c5ccccc5)c5ccc6oc7ccccc7c6c5)cccc4c3c2)cc1.
What is the InChIKey of 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine?
The InChIKey is MEMYXKLWIDJFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2O2/c1-4-13-29(14-5-1)43(30-15-6-2-7-16-30)32-23-26-41-37(27-32)35-20-12-21-38(42(35)46-41)44(31-17-8-3-9-18-31)33-24-25-40-36(28-33)34-19-10-11-22-39(34)45-40/h1-28H.
What are the key properties of 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine?
6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine has a molecular weight of 592.70 g/mol, XLogP of 12.43, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-dibenzofuran-2-yl-2-N,2-N,6-N-triphenyldibenzofuran-2,6-diamine is sourced from PubChem (CID 167208512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).