8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine

C48H29NO3 — CID 174244453

IUPAC8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3oc4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)oc8ccccc89)cc7c6c5)cc4c23)cc1
InChIInChI=1S/C48H29NO3/c1-3-10-34(11-4-1)49(35-12-5-2-6-13-35)41-15-9-17-46-48(41)40-28-32(21-25-45(40)51-46)30-19-23-43-38(26-30)39-27-31(20-24-44(39)50-43)33-18-22-37-36-14-7-8-16-42(36)52-47(37)29-33/h1-29H
InChIKeyYAOBZRINTROSIN-UHFFFAOYSA-N
MW667.76 g/mol
LogP14.19
Rot. Bonds5

About 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine

8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine (PubChem CID 174244453) has the molecular formula C48H29NO3 and a molecular weight of 667.76 g/mol. Its IUPAC name is 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine.

Molecular Properties

Compound Name8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine
PubChem CID174244453
Molecular FormulaC48H29NO3
Molecular Weight667.76 g/mol
Exact Mass667.21
IUPAC Name8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine
SMILESc1ccc(N(c2ccccc2)c2cccc3oc4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)oc8ccccc89)cc7c6c5)cc4c23)cc1
InChIInChI=1S/C48H29NO3/c1-3-10-34(11-4-1)49(35-12-5-2-6-13-35)41-15-9-17-46-48(41)40-28-32(21-25-45(40)51-46)30-19-23-43-38(26-30)39-27-31(20-24-44(39)50-43)33-18-22-37-36-14-7-8-16-42(36)52-47(37)29-33/h1-29H
InChIKeyYAOBZRINTROSIN-UHFFFAOYSA-N
XLogP14.19
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500667.76
LogP ≤ 514.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,17-triphenyl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4,6,8,12,14(19),15,17-nonaen-5-amine
CID 171050359
N,N-bis(4-phenylphenyl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4,6,8,12,14,16,18-nonaen-5-amine
CID 171050107
N-[4-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-1-amine
CID 174321862
8-phenyl-N,N-bis[4-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 167397321
N-(4-dibenzofuran-2-ylphenyl)-N-phenylnaphtho[1,2-b][1]benzofuran-7-amine
CID 171738174
8-N,22-N-di(dibenzofuran-1-yl)-8-N,22-N-diphenyl-11,15,19-trioxaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20(25),21,23,26-dodecaene-8,22-diamine
CID 170235172
8-N-dibenzofuran-3-yl-8-N-(4-naphthalen-2-ylphenyl)-1-N,1-N-diphenyldibenzofuran-1,8-diamine
CID 146573619
N-(4-dibenzofuran-2-ylphenyl)-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-1-amine
CID 172502866
1-N-dibenzofuran-3-yl-1-N,7-N,7-N-triphenyldibenzofuran-1,7-diamine
CID 146573998
7-(7-dibenzofuran-3-yldibenzofuran-3-yl)-N-phenyl-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 174244796
1-N-dibenzofuran-2-yl-1-N,5-N-diphenyl-5-N-(4-phenylphenyl)naphthalene-1,5-diamine
CID 166917710
N-[3-[3-[N-dibenzofuran-1-yl-4-(4-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 167086573

Frequently Asked Questions

What is the IUPAC name of 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine?
The IUPAC name of 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine (CID 174244453) is 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine.
What is the SMILES notation for 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine?
The canonical SMILES for 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine is c1ccc(N(c2ccccc2)c2cccc3oc4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)oc8ccccc89)cc7c6c5)cc4c23)cc1.
What is the InChIKey of 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine?
The InChIKey is YAOBZRINTROSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H29NO3/c1-3-10-34(11-4-1)49(35-12-5-2-6-13-35)41-15-9-17-46-48(41)40-28-32(21-25-45(40)51-46)30-19-23-43-38(26-30)39-27-31(20-24-44(39)50-43)33-18-22-37-36-14-7-8-16-42(36)52-47(37)29-33/h1-29H.
What are the key properties of 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine?
8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine has a molecular weight of 667.76 g/mol, XLogP of 14.19, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(8-dibenzofuran-3-yldibenzofuran-2-yl)-N,N-diphenyldibenzofuran-1-amine is sourced from PubChem (CID 174244453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).