N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine

C90H56N2O2 — CID 140862681

IUPACN-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine
SMILESc1ccc(C2(C3(c4ccccc4)c4ccccc4-c4c3cc(N(c3ccc5ccccc5c3)c3cccc5c3oc3ccccc35)c3ccccc43)c3ccccc3-c3c2cc(N(c2ccc4ccccc4c2)c2cccc4c2oc2ccccc24)c2ccccc32)cc1
InChIInChI=1S/C90H56N2O2/c1-3-29-61(30-4-1)89(75-43-19-15-39-73(75)85-69-37-13-11-33-65(69)81(55-77(85)89)91(63-51-49-57-25-7-9-27-59(57)53-63)79-45-23-41-71-67-35-17-21-47-83(67)93-87(71)79)90(62-31-5-2-6-32-62)76-44-20-16-40-74(76)86-70-38-14-12-34-66(70)82(56-78(86)90)92(64-52-50-58-26-8-10-28-60(58)54-64)80-46-24-42-72-68-36-18-22-48-84(68)94-88(72)80/h1-56H
InChIKeyUSXPANKAABXJOO-UHFFFAOYSA-N
MW1197.45 g/mol
LogP24.37
Rot. Bonds9

About N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine

N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine (PubChem CID 140862681) has the molecular formula C90H56N2O2 and a molecular weight of 1197.45 g/mol. Its IUPAC name is N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine.

Molecular Properties

Compound NameN-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine
PubChem CID140862681
Molecular FormulaC90H56N2O2
Molecular Weight1197.45 g/mol
Exact Mass1196.43
IUPAC NameN-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine
SMILESc1ccc(C2(C3(c4ccccc4)c4ccccc4-c4c3cc(N(c3ccc5ccccc5c3)c3cccc5c3oc3ccccc35)c3ccccc43)c3ccccc3-c3c2cc(N(c2ccc4ccccc4c2)c2cccc4c2oc2ccccc24)c2ccccc32)cc1
InChIInChI=1S/C90H56N2O2/c1-3-29-61(30-4-1)89(75-43-19-15-39-73(75)85-69-37-13-11-33-65(69)81(55-77(85)89)91(63-51-49-57-25-7-9-27-59(57)53-63)79-45-23-41-71-67-35-17-21-47-83(67)93-87(71)79)90(62-31-5-2-6-32-62)76-44-20-16-40-74(76)86-70-38-14-12-34-66(70)82(56-78(86)90)92(64-52-50-58-26-8-10-28-60(58)54-64)80-46-24-42-72-68-36-18-22-48-84(68)94-88(72)80/h1-56H
InChIKeyUSXPANKAABXJOO-UHFFFAOYSA-N
XLogP24.37
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001197.45
LogP ≤ 524.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine with MolForge

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Related Compounds

N-dibenzofuran-4-yl-N-[12-[9-[di(dibenzofuran-4-yl)amino]-12-phenyl-12-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]-12-phenyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]dibenzofuran-4-amine
CID 134432579
N-[12-[9-[dibenzofuran-4-yl(pyren-1-yl)amino]-12-phenyl-12-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]-12-phenyl-9-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]-N-pyren-1-yldibenzofuran-4-amine
CID 140862645
N-[7-[5-(N-dibenzofuran-4-yl-4-phenylanilino)-7-methylbenzo[c]fluoren-7-yl]-7-methylbenzo[c]fluoren-5-yl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 140862629
9-N',17-N'-di(dibenzofuran-4-yl)-9-N',17-N'-bis(4-propan-2-ylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-9',17'-diamine
CID 137492809
N-chrysen-1-yl-N-naphthalen-2-yldibenzofuran-4-amine
CID 170130871
N-[4-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-4-amine
CID 177114196
N-phenyl-N-spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-17'-yldibenzofuran-4-amine
CID 140962343
7-N',17-N'-di(dibenzofuran-4-yl)-7-N',17-N'-bis(2-methylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-7',17'-diamine
CID 137493213
N-dibenzofuran-4-yl-N-(9,9-diphenylfluoren-3-yl)dibenzofuran-4-amine
CID 121424846
N-naphthalen-2-yl-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-4-amine
CID 172501495
N,N,7-triphenyl-7-[7-phenyl-5-(N-phenylanilino)benzo[c]fluoren-7-yl]benzo[c]fluoren-5-amine
CID 134432446
N-[4-(9-phenylfluoren-9-yl)phenyl]-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-4-amine
CID 121381379

Frequently Asked Questions

What is the IUPAC name of N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine?
The IUPAC name of N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine (CID 140862681) is N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine.
What is the SMILES notation for N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine?
The canonical SMILES for N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine is c1ccc(C2(C3(c4ccccc4)c4ccccc4-c4c3cc(N(c3ccc5ccccc5c3)c3cccc5c3oc3ccccc35)c3ccccc43)c3ccccc3-c3c2cc(N(c2ccc4ccccc4c2)c2cccc4c2oc2ccccc24)c2ccccc32)cc1.
What is the InChIKey of N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine?
The InChIKey is USXPANKAABXJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H56N2O2/c1-3-29-61(30-4-1)89(75-43-19-15-39-73(75)85-69-37-13-11-33-65(69)81(55-77(85)89)91(63-51-49-57-25-7-9-27-59(57)53-63)79-45-23-41-71-67-35-17-21-47-83(67)93-87(71)79)90(62-31-5-2-6-32-62)76-44-20-16-40-74(76)86-70-38-14-12-34-66(70)82(56-78(86)90)92(64-52-50-58-26-8-10-28-60(58)54-64)80-46-24-42-72-68-36-18-22-48-84(68)94-88(72)80/h1-56H.
What are the key properties of N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine?
N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine has a molecular weight of 1197.45 g/mol, XLogP of 24.37, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-[5-[dibenzofuran-4-yl(naphthalen-2-yl)amino]-7-phenylbenzo[c]fluoren-7-yl]-7-phenylbenzo[c]fluoren-5-yl]-N-naphthalen-2-yldibenzofuran-4-amine is sourced from PubChem (CID 140862681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).