N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine

C199H140N6S — CID 159270785

IUPACN-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
SMILESC1=CC(c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2ccc3sc4ccccc4c3c2)=CCC1.CC1(C)c2ccccc2-c2c(N(c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)c3ccccc3-c3ccccc3C3=CCCC=C3)cccc21.c1ccc(-c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C74H50N2.C64H48N2.C61H42N2S/c1-5-26-51(27-6-1)56-34-13-14-35-57(56)60-37-17-22-44-68(60)76(71-47-25-43-66-72(71)61-38-16-19-40-63(61)73(66,52-28-7-2-8-29-52)53-30-9-3-10-31-53)55-48-49-59-58-36-15-18-39-62(58)74(67(59)50-55)64-41-20-23-45-69(64)75(54-32-11-4-12-33-54)70-46-24-21-42-65(70)74;1-63(2)52-31-14-12-30-51(52)62-56(63)35-21-39-61(62)66(58-36-18-13-29-50(58)47-27-10-9-26-46(47)43-22-5-3-6-23-43)45-40-41-49-48-28-11-15-32-53(48)64(57(49)42-45)54-33-16-19-37-59(54)65(44-24-7-4-8-25-44)60-38-20-17-34-55(60)64;1-3-19-41(20-4-1)45-23-7-8-24-46(45)49-26-10-15-31-56(49)62(43-36-38-60-51(39-43)50-27-11-18-34-59(50)64-60)44-35-37-48-47-25-9-12-28-52(47)61(55(48)40-44)53-29-13-16-32-57(53)63(42-21-5-2-6-22-42)58-33-17-14-30-54(58)61/h1-50H;4-5,7-42H,3,6H2,1-2H3;2-3,5-40H,1,4H2
InChIKeyKXRLMPKIICFRRA-UHFFFAOYSA-N
MW2647.42 g/mol
LogP53.08
Rot. Bonds20

About N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine

N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 159270785) has the molecular formula C199H140N6S and a molecular weight of 2647.42 g/mol. Its IUPAC name is N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.

Molecular Properties

Compound NameN-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
PubChem CID159270785
Molecular FormulaC199H140N6S
Molecular Weight2647.42 g/mol
Exact Mass2645.09
IUPAC NameN-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
SMILESC1=CC(c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2ccc3sc4ccccc4c3c2)=CCC1.CC1(C)c2ccccc2-c2c(N(c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)c3ccccc3-c3ccccc3C3=CCCC=C3)cccc21.c1ccc(-c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C74H50N2.C64H48N2.C61H42N2S/c1-5-26-51(27-6-1)56-34-13-14-35-57(56)60-37-17-22-44-68(60)76(71-47-25-43-66-72(71)61-38-16-19-40-63(61)73(66,52-28-7-2-8-29-52)53-30-9-3-10-31-53)55-48-49-59-58-36-15-18-39-62(58)74(67(59)50-55)64-41-20-23-45-69(64)75(54-32-11-4-12-33-54)70-46-24-21-42-65(70)74;1-63(2)52-31-14-12-30-51(52)62-56(63)35-21-39-61(62)66(58-36-18-13-29-50(58)47-27-10-9-26-46(47)43-22-5-3-6-23-43)45-40-41-49-48-28-11-15-32-53(48)64(57(49)42-45)54-33-16-19-37-59(54)65(44-24-7-4-8-25-44)60-38-20-17-34-55(60)64;1-3-19-41(20-4-1)45-23-7-8-24-46(45)49-26-10-15-31-56(49)62(43-36-38-60-51(39-43)50-27-11-18-34-59(50)64-60)44-35-37-48-47-25-9-12-28-52(47)61(55(48)40-44)53-29-13-16-32-57(53)63(42-21-5-2-6-22-42)58-33-17-14-30-54(58)61/h1-50H;4-5,7-42H,3,6H2,1-2H3;2-3,5-40H,1,4H2
InChIKeyKXRLMPKIICFRRA-UHFFFAOYSA-N
XLogP53.08
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds20
Heavy Atoms206
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002647.42
LogP ≤ 553.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-dibenzothiophen-2-yl-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166688
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 158548002
N-(3-dibenzothiophen-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 155240036
N-dibenzothiophen-1-yl-N-(9,9-diphenylfluoren-2-yl)-1,9,13-triphenyl-13-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,10,12(20),14,16,18-nonaen-4-amine
CID 168750866
N-dibenzothiophen-2-yl-1,5,13-triphenyl-N-(9,9'-spirobi[fluorene]-2-yl)-13-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-amine
CID 168750862
N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 157340492
N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168927
N-(9,9-dimethylfluoren-4-yl)-10-phenyl-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166608
N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168816
N-(9,9-diphenylfluoren-2-yl)-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135168780
N-(9,9-dimethylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166847
N-(4-dibenzothiophen-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166813

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?
The IUPAC name of N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (CID 159270785) is N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.
What is the SMILES notation for N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?
The canonical SMILES for N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is C1=CC(c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2ccc3sc4ccccc4c3c2)=CCC1.CC1(C)c2ccccc2-c2c(N(c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)c3ccccc3-c3ccccc3C3=CCCC=C3)cccc21.c1ccc(-c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?
The InChIKey is KXRLMPKIICFRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H50N2.C64H48N2.C61H42N2S/c1-5-26-51(27-6-1)56-34-13-14-35-57(56)60-37-17-22-44-68(60)76(71-47-25-43-66-72(71)61-38-16-19-40-63(61)73(66,52-28-7-2-8-29-52)53-30-9-3-10-31-53)55-48-49-59-58-36-15-18-39-62(58)74(67(59)50-55)64-41-20-23-45-69(64)75(54-32-11-4-12-33-54)70-46-24-21-42-65(70)74;1-63(2)52-31-14-12-30-51(52)62-56(63)35-21-39-61(62)66(58-36-18-13-29-50(58)47-27-10-9-26-46(47)43-22-5-3-6-23-43)45-40-41-49-48-28-11-15-32-53(48)64(57(49)42-45)54-33-16-19-37-59(54)65(44-24-7-4-8-25-44)60-38-20-17-34-55(60)64;1-3-19-41(20-4-1)45-23-7-8-24-46(45)49-26-10-15-31-56(49)62(43-36-38-60-51(39-43)50-27-11-18-34-59(50)64-60)44-35-37-48-47-25-9-12-28-52(47)61(55(48)40-44)53-29-13-16-32-57(53)63(42-21-5-2-6-22-42)58-33-17-14-30-54(58)61/h1-50H;4-5,7-42H,3,6H2,1-2H3;2-3,5-40H,1,4H2.
What are the key properties of N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?
N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine has a molecular weight of 2647.42 g/mol, XLogP of 53.08, 20 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-dibenzothiophen-2-yl-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-cyclohexa-1,5-dien-1-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-4-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-4-yl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 159270785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).