N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine

C96H64N2O3 — CID 174180372

IUPACN-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc(-c4cccc(-c5ccc6c(c5)C(C)(C)c5cc(N(c7ccc8ccccc8c7)c7ccc(-c8ccccc8)c8c7oc7c9ccccc9ccc78)ccc5-6)c4)c4c3oc3c5ccccc5ccc34)cc21
InChIInChI=1S/C96H64N2O3/c1-95(2)81-31-16-14-29-73(81)75-44-38-67(54-83(75)95)98(68-40-46-78-77-30-15-17-32-87(77)99-88(78)56-68)86-50-48-70(90-80-43-35-60-23-11-13-28-72(60)92(80)101-94(86)90)64-26-18-25-61(51-64)63-36-41-74-76-45-39-66(55-84(76)96(3,4)82(74)53-63)97(65-37-33-57-19-8-9-24-62(57)52-65)85-49-47-69(58-20-6-5-7-21-58)89-79-42-34-59-22-10-12-27-71(59)91(79)100-93(85)89/h5-56H,1-4H3
InChIKeyAMHAMIAUODNSPK-UHFFFAOYSA-N
MW1293.58 g/mol
LogP27.40
Rot. Bonds9

About N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine

N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine (PubChem CID 174180372) has the molecular formula C96H64N2O3 and a molecular weight of 1293.58 g/mol. Its IUPAC name is N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine.

Molecular Properties

Compound NameN-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine
PubChem CID174180372
Molecular FormulaC96H64N2O3
Molecular Weight1293.58 g/mol
Exact Mass1292.49
IUPAC NameN-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc(-c4cccc(-c5ccc6c(c5)C(C)(C)c5cc(N(c7ccc8ccccc8c7)c7ccc(-c8ccccc8)c8c7oc7c9ccccc9ccc78)ccc5-6)c4)c4c3oc3c5ccccc5ccc34)cc21
InChIInChI=1S/C96H64N2O3/c1-95(2)81-31-16-14-29-73(81)75-44-38-67(54-83(75)95)98(68-40-46-78-77-30-15-17-32-87(77)99-88(78)56-68)86-50-48-70(90-80-43-35-60-23-11-13-28-72(60)92(80)101-94(86)90)64-26-18-25-61(51-64)63-36-41-74-76-45-39-66(55-84(76)96(3,4)82(74)53-63)97(65-37-33-57-19-8-9-24-62(57)52-65)85-49-47-69(58-20-6-5-7-21-58)89-79-42-34-59-22-10-12-27-71(59)91(79)100-93(85)89/h5-56H,1-4H3
InChIKeyAMHAMIAUODNSPK-UHFFFAOYSA-N
XLogP27.40
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms101
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001293.58
LogP ≤ 527.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine?
The IUPAC name of N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine (CID 174180372) is N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine.
What is the SMILES notation for N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine?
The canonical SMILES for N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc(-c4cccc(-c5ccc6c(c5)C(C)(C)c5cc(N(c7ccc8ccccc8c7)c7ccc(-c8ccccc8)c8c7oc7c9ccccc9ccc78)ccc5-6)c4)c4c3oc3c5ccccc5ccc34)cc21.
What is the InChIKey of N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine?
The InChIKey is AMHAMIAUODNSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H64N2O3/c1-95(2)81-31-16-14-29-73(81)75-44-38-67(54-83(75)95)98(68-40-46-78-77-30-15-17-32-87(77)99-88(78)56-68)86-50-48-70(90-80-43-35-60-23-11-13-28-72(60)92(80)101-94(86)90)64-26-18-25-61(51-64)63-36-41-74-76-45-39-66(55-84(76)96(3,4)82(74)53-63)97(65-37-33-57-19-8-9-24-62(57)52-65)85-49-47-69(58-20-6-5-7-21-58)89-79-42-34-59-22-10-12-27-71(59)91(79)100-93(85)89/h5-56H,1-4H3.
What are the key properties of N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine?
N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine has a molecular weight of 1293.58 g/mol, XLogP of 27.40, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-[3-[10-[dibenzofuran-3-yl-(9,9-dimethylfluoren-2-yl)amino]naphtho[1,2-b][1]benzofuran-7-yl]phenyl]-9,9-dimethylfluoren-2-yl]-N-naphthalen-2-yl-7-phenylnaphtho[1,2-b][1]benzofuran-10-amine is sourced from PubChem (CID 174180372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).