N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine

C87H73FN4O — CID 23594453

IUPACN-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine
SMILESCc1ccc2oc3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc(N(c%10ccc(C)c(C)c%10)c%10ccc(C)c(C)c%10)cc9)cc8)c8ccc(C)c(C)c8)cc7)cc6)c6ccc(C)c(C)c6)cc5)cc4)c4cccc(F)c4)cc3c2c1
InChIInChI=1S/C87H73FN4O/c1-56-13-47-86-84(49-56)85-55-83(46-48-87(85)93-86)91(78-12-10-11-71(88)54-78)76-42-26-69(27-43-76)67-22-38-74(39-23-67)89(79-30-14-57(2)61(6)50-79)72-34-18-65(19-35-72)66-20-36-73(37-21-66)90(80-31-15-58(3)62(7)51-80)75-40-24-68(25-41-75)70-28-44-77(45-29-70)92(81-32-16-59(4)63(8)52-81)82-33-17-60(5)64(9)53-82/h10-55H,1-9H3
InChIKeyODILSZHGCWDIKM-UHFFFAOYSA-N
MW1209.57 g/mol
LogP25.38
Rot. Bonds15

About N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine

N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine (PubChem CID 23594453) has the molecular formula C87H73FN4O and a molecular weight of 1209.57 g/mol. Its IUPAC name is N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine.

Molecular Properties

Compound NameN-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine
PubChem CID23594453
Molecular FormulaC87H73FN4O
Molecular Weight1209.57 g/mol
Exact Mass1208.58
IUPAC NameN-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine
SMILESCc1ccc2oc3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc(N(c%10ccc(C)c(C)c%10)c%10ccc(C)c(C)c%10)cc9)cc8)c8ccc(C)c(C)c8)cc7)cc6)c6ccc(C)c(C)c6)cc5)cc4)c4cccc(F)c4)cc3c2c1
InChIInChI=1S/C87H73FN4O/c1-56-13-47-86-84(49-56)85-55-83(46-48-87(85)93-86)91(78-12-10-11-71(88)54-78)76-42-26-69(27-43-76)67-22-38-74(39-23-67)89(79-30-14-57(2)61(6)50-79)72-34-18-65(19-35-72)66-20-36-73(37-21-66)90(80-31-15-58(3)62(7)51-80)75-40-24-68(25-41-75)70-28-44-77(45-29-70)92(81-32-16-59(4)63(8)52-81)82-33-17-60(5)64(9)53-82/h10-55H,1-9H3
InChIKeyODILSZHGCWDIKM-UHFFFAOYSA-N
XLogP25.38
TPSA26.10 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms93
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001209.57
LogP ≤ 525.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine with MolForge

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Related Compounds

8-N-[8-(3-methyl-N-(3-methylphenyl)anilino)dibenzofuran-2-yl]-2-N-[4-[4-(4-methyl-N-(3-methylphenyl)anilino)phenyl]phenyl]-2-N,8-N-bis(3-methylphenyl)dibenzofuran-2,8-diamine
CID 23594512
8-methyl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine
CID 163712380
2-N,8-N-bis(3,4-dimethylphenyl)-2-N-methyl-8-N-[4-(4-methylphenyl)phenyl]dibenzothiophene-2,8-diamine;ethane;2-N-methyl-2-N,8-N-bis(3-methylphenyl)-8-N-[4-(4-methylphenyl)phenyl]dibenzofuran-2,8-diamine;2-N-methyl-2-N,8-N-bis(4-methylphenyl)-8-N-[4-(4-methylphenyl)phenyl]dibenzothiophene-2,8-diamine;2-N-methyl-8-N-[4-(4-methylphenyl)phenyl]-2-N,8-N-diphenyldibenzothiophene-2,8-diamine
CID 158388739
2-N,8-N-diphenyl-2-N,8-N-bis[4-(N-(4-phenylphenyl)anilino)phenyl]dibenzofuran-2,8-diamine
CID 145264524
3-fluoro-N-[4-[4-(4-fluoro-N-methylanilino)phenyl]phenyl]-N-[4-(4-methylphenyl)phenyl]aniline
CID 23593123
2-N,8-N-bis(4-bromophenyl)-2-N,8-N-bis(4-methylphenyl)dibenzofuran-2,8-diamine;2-N,8-N-bis(4-methylphenyl)-2-N,8-N-diphenyldibenzofuran-2,8-diamine
CID 164952868
N-[4-[4-[4-(N-(3,4-dimethylphenyl)anilino)phenyl]phenyl]phenyl]-3,4-dimethyl-N-phenylaniline
CID 137434908
N-(4-dibenzofuran-2-ylphenyl)-N-[4-[4-(N-(4-dibenzofuran-2-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline
CID 59022088
N-phenyl-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 174245859
2,4-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-[4-[4-[N-methyl-4-(trifluoromethyl)anilino]phenyl]phenyl]aniline;3,4-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-[4-[4-[N-methyl-4-(trifluoromethyl)anilino]phenyl]phenyl]aniline;ethane;3-fluoro-N-[4-[4-(4-fluoro-N-methylanilino)phenyl]phenyl]-N-[4-(4-methylphenyl)phenyl]aniline;N-(4-fluorophenyl)-N-methyl-4-[4-[4-(4-methylphenyl)-N-[4-(trifluoromethyl)phenyl]anilino]phenyl]aniline
CID 159145250
N-(3,4-dimethylphenyl)-3,4-dimethyl-N-(4-methylphenyl)aniline;ethane
CID 143481987
N-(3-methyl-4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 138488713

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine?
The IUPAC name of N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine (CID 23594453) is N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine.
What is the SMILES notation for N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine?
The canonical SMILES for N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine is Cc1ccc2oc3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc(N(c%10ccc(C)c(C)c%10)c%10ccc(C)c(C)c%10)cc9)cc8)c8ccc(C)c(C)c8)cc7)cc6)c6ccc(C)c(C)c6)cc5)cc4)c4cccc(F)c4)cc3c2c1.
What is the InChIKey of N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine?
The InChIKey is ODILSZHGCWDIKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C87H73FN4O/c1-56-13-47-86-84(49-56)85-55-83(46-48-87(85)93-86)91(78-12-10-11-71(88)54-78)76-42-26-69(27-43-76)67-22-38-74(39-23-67)89(79-30-14-57(2)61(6)50-79)72-34-18-65(19-35-72)66-20-36-73(37-21-66)90(80-31-15-58(3)62(7)51-80)75-40-24-68(25-41-75)70-28-44-77(45-29-70)92(81-32-16-59(4)63(8)52-81)82-33-17-60(5)64(9)53-82/h10-55H,1-9H3.
What are the key properties of N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine?
N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine has a molecular weight of 1209.57 g/mol, XLogP of 25.38, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[N-(3,4-dimethylphenyl)-4-[4-[N-(3,4-dimethylphenyl)-4-[4-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N-(3-fluorophenyl)-8-methyldibenzofuran-2-amine is sourced from PubChem (CID 23594453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).