N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine

C56H40N2O2 — CID 134392952

IUPACN-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)oc1cccc(N(c2ccc4c(c2)oc2ccccc24)c2ccc4c5c(n(-c6ccccc6)c4c2)-c2ccccc2C5(C)C)c13
InChIInChI=1S/C56H40N2O2/c1-55(2)43-20-11-8-17-36(43)41-31-42-51(32-45(41)55)60-49-24-14-22-46(52(42)49)57(35-25-27-38-37-18-10-13-23-48(37)59-50(38)30-35)34-26-28-40-47(29-34)58(33-15-6-5-7-16-33)54-39-19-9-12-21-44(39)56(3,4)53(40)54/h5-32H,1-4H3
InChIKeyNMEWBORCBVZZDO-UHFFFAOYSA-N
MW772.95 g/mol
LogP15.51
Rot. Bonds4

About N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine

N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine (PubChem CID 134392952) has the molecular formula C56H40N2O2 and a molecular weight of 772.95 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine
PubChem CID134392952
Molecular FormulaC56H40N2O2
Molecular Weight772.95 g/mol
Exact Mass772.31
IUPAC NameN-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)oc1cccc(N(c2ccc4c(c2)oc2ccccc24)c2ccc4c5c(n(-c6ccccc6)c4c2)-c2ccccc2C5(C)C)c13
InChIInChI=1S/C56H40N2O2/c1-55(2)43-20-11-8-17-36(43)41-31-42-51(32-45(41)55)60-49-24-14-22-46(52(42)49)57(35-25-27-38-37-18-10-13-23-48(37)59-50(38)30-35)34-26-28-40-47(29-34)58(33-15-6-5-7-16-33)54-39-19-9-12-21-44(39)56(3,4)53(40)54/h5-32H,1-4H3
InChIKeyNMEWBORCBVZZDO-UHFFFAOYSA-N
XLogP15.51
TPSA34.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500772.95
LogP ≤ 515.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine with MolForge

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Related Compounds

N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-11,11-dimethyl-N,3-diphenyl-3-azapentacyclo[10.8.0.02,10.04,9.015,20]icosa-1(12),2(10),4(9),5,7,13,15,17,19-nonaen-6-amine
CID 134392953
7,7-dimethyl-N-phenyl-N-(4-phenylphenyl)fluoreno[2,3-b][1]benzofuran-1-amine
CID 134393175
N-(9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-3-yl)-7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-amine
CID 170353028
N-[4-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-N-(9,9'-spirobi[fluorene]-3-yl)dibenzofuran-3-amine
CID 126702849
N-(9,9-dimethylfluoren-1-yl)-8-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 138484695
N-[4-[5-(4-dibenzofuran-4-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 126702847
N-(3-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9-phenylcarbazol-2-amine
CID 170139036
N-dibenzofuran-1-yl-N-(9,9-dimethylfluoren-2-yl)spiro[fluoreno[2,3-b][1]benzofuran-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine
CID 130463025
N-(9,9-dimethylfluoren-3-yl)-N-(4-phenylphenyl)-8-[9-(3-phenylphenyl)carbazol-3-yl]dibenzofuran-1-amine
CID 138484698
N-(9,9-dimethylfluoren-4-yl)-N-naphthalen-2-yl-8-(5-phenylbenzo[b]carbazol-2-yl)dibenzofuran-1-amine
CID 138484797
N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]dibenzofuran-1-amine;methane
CID 158611261
N-(9,9-dimethylfluoren-2-yl)-N-(9,9-dimethyl-6-phenylfluoren-4-yl)-8-(9-phenylcarbazol-3-yl)dibenzofuran-1-amine
CID 138577371

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine?
The IUPAC name of N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine (CID 134392952) is N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine?
The canonical SMILES for N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine is CC1(C)c2ccccc2-c2cc3c(cc21)oc1cccc(N(c2ccc4c(c2)oc2ccccc24)c2ccc4c5c(n(-c6ccccc6)c4c2)-c2ccccc2C5(C)C)c13.
What is the InChIKey of N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine?
The InChIKey is NMEWBORCBVZZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H40N2O2/c1-55(2)43-20-11-8-17-36(43)41-31-42-51(32-45(41)55)60-49-24-14-22-46(52(42)49)57(35-25-27-38-37-18-10-13-23-48(37)59-50(38)30-35)34-26-28-40-47(29-34)58(33-15-6-5-7-16-33)54-39-19-9-12-21-44(39)56(3,4)53(40)54/h5-32H,1-4H3.
What are the key properties of N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine?
N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine has a molecular weight of 772.95 g/mol, XLogP of 15.51, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-N-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indol-7-amine is sourced from PubChem (CID 134392952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).