N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine

C135H93N3O2S — CID 158296890

IUPACN-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc(-c4ccccc4)c4sc5ccccc5c4c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C49H35NS.C46H31NO.C40H27NO/c1-49(2)45-18-10-8-16-40(45)41-27-26-38(31-46(41)49)50(37-24-22-33(23-25-37)36-21-20-32-12-6-7-15-35(32)28-36)39-29-43(34-13-4-3-5-14-34)48-44(30-39)42-17-9-11-19-47(42)51-48;1-3-11-32(12-4-1)35-21-25-39(26-22-35)47(40-27-23-36(24-28-40)33-13-5-2-6-14-33)41-30-43(38-20-19-34-15-7-8-16-37(34)29-38)46-44(31-41)42-17-9-10-18-45(42)48-46;1-3-11-28(12-4-1)30-21-23-34(24-22-30)41(33-15-5-2-6-16-33)35-26-37(32-20-19-29-13-7-8-14-31(29)25-32)40-38(27-35)36-17-9-10-18-39(36)42-40/h3-31H,1-2H3;1-31H;1-27H
InChIKeyGMAFXVFHFXDHAY-UHFFFAOYSA-N
MW1821.31 g/mol
LogP39.07
Rot. Bonds16

About N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine

N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine (PubChem CID 158296890) has the molecular formula C135H93N3O2S and a molecular weight of 1821.31 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine
PubChem CID158296890
Molecular FormulaC135H93N3O2S
Molecular Weight1821.31 g/mol
Exact Mass1819.70
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc(-c4ccccc4)c4sc5ccccc5c4c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C49H35NS.C46H31NO.C40H27NO/c1-49(2)45-18-10-8-16-40(45)41-27-26-38(31-46(41)49)50(37-24-22-33(23-25-37)36-21-20-32-12-6-7-15-35(32)28-36)39-29-43(34-13-4-3-5-14-34)48-44(30-39)42-17-9-11-19-47(42)51-48;1-3-11-32(12-4-1)35-21-25-39(26-22-35)47(40-27-23-36(24-28-40)33-13-5-2-6-14-33)41-30-43(38-20-19-34-15-7-8-16-37(34)29-38)46-44(31-41)42-17-9-10-18-45(42)48-46;1-3-11-28(12-4-1)30-21-23-34(24-22-30)41(33-15-5-2-6-16-33)35-26-37(32-20-19-29-13-7-8-14-31(29)25-32)40-38(27-35)36-17-9-10-18-39(36)42-40/h3-31H,1-2H3;1-31H;1-27H
InChIKeyGMAFXVFHFXDHAY-UHFFFAOYSA-N
XLogP39.07
TPSA36.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms141
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001821.31
LogP ≤ 539.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)dibenzothiophen-2-amine
CID 140919142
N-(9,9-dimethylfluoren-2-yl)-N-phenyl-4-(4-phenylphenyl)dibenzothiophen-2-amine
CID 140919448
4-(4-dibenzofuran-4-yldibenzothiophen-2-yl)-N,N-diphenylaniline;4-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine;4-(4-dibenzothiophen-4-yldibenzothiophen-2-yl)-N,N-diphenylaniline
CID 162033020
N-[4-(4-dibenzofuran-2-yldibenzothiophen-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine;4-dibenzothiophen-4-yl-N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 157081816
9,9-dimethyl-N-[3-(9-oxa-20-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 167132714
9,9-dimethyl-N-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 167132696
N-[4-(4-dibenzofuran-2-yldibenzothiophen-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 140919493
N-(4-dibenzofuran-4-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)-4-naphthalen-2-yl-N-(4-phenylphenyl)aniline
CID 146270972
N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-7-phenylfluoren-2-amine
CID 67964342
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-amine;N-(3,5-diphenylphenyl)-N-phenylspiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-amine;N-(4-naphthalen-2-ylphenyl)-N-phenylspiro[fluorene-9,7'-fluoreno[4,3-b][1]benzothiole]-2-amine
CID 164985809
4-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-phenylaniline;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-2-yl-7-phenylfluoren-2-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-(9,9-dimethyl-7-phenylfluoren-2-yl)anthracen-2-amine
CID 157416955
N-(2-dibenzofuran-4-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-dibenzofuran-4-yl-N-(9,9'-spirobi[fluorene]-2-yl)dibenzofuran-4-amine;N-(2-dibenzothiophen-4-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-dibenzothiophen-4-yl-N-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-4-amine;N-(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine
CID 164966270

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine (CID 158296890) is N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc(-c4ccccc4)c4sc5ccccc5c4c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc5ccccc5c4)c4oc5ccccc5c4c3)cc2)cc1.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The InChIKey is GMAFXVFHFXDHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H35NS.C46H31NO.C40H27NO/c1-49(2)45-18-10-8-16-40(45)41-27-26-38(31-46(41)49)50(37-24-22-33(23-25-37)36-21-20-32-12-6-7-15-35(32)28-36)39-29-43(34-13-4-3-5-14-34)48-44(30-39)42-17-9-11-19-47(42)51-48;1-3-11-32(12-4-1)35-21-25-39(26-22-35)47(40-27-23-36(24-28-40)33-13-5-2-6-14-33)41-30-43(38-20-19-34-15-7-8-16-37(34)29-38)46-44(31-41)42-17-9-10-18-45(42)48-46;1-3-11-28(12-4-1)30-21-23-34(24-22-30)41(33-15-5-2-6-16-33)35-26-37(32-20-19-29-13-7-8-14-31(29)25-32)40-38(27-35)36-17-9-10-18-39(36)42-40/h3-31H,1-2H3;1-31H;1-27H.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine?
N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine has a molecular weight of 1821.31 g/mol, XLogP of 39.07, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-4-phenyldibenzothiophen-2-amine;4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-2-amine is sourced from PubChem (CID 158296890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).