N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine

C70H50N2 — CID 155240757

IUPACN-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc(N(c5ccc6c(c5)C5(c7ccccc7-6)c6ccccc6N(c6ccccc6)c6ccccc65)c5ccccc5-c5ccccc5)cc4)cc3)cc21
InChIInChI=1S/C70H50N2/c1-69(2)60-26-12-9-24-56(60)58-43-39-51(45-64(58)69)49-35-33-47(34-36-49)48-37-40-53(41-38-48)71(66-30-16-11-23-55(66)50-19-5-3-6-20-50)54-42-44-59-57-25-10-13-27-61(57)70(65(59)46-54)62-28-14-17-31-67(62)72(52-21-7-4-8-22-52)68-32-18-15-29-63(68)70/h3-46H,1-2H3
InChIKeyTXWVRAMSKPZSNP-UHFFFAOYSA-N
MW919.18 g/mol
LogP18.61
Rot. Bonds7

About N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine

N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 155240757) has the molecular formula C70H50N2 and a molecular weight of 919.18 g/mol. Its IUPAC name is N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine.

Molecular Properties

Compound NameN-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
PubChem CID155240757
Molecular FormulaC70H50N2
Molecular Weight919.18 g/mol
Exact Mass918.40
IUPAC NameN-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc(N(c5ccc6c(c5)C5(c7ccccc7-6)c6ccccc6N(c6ccccc6)c6ccccc65)c5ccccc5-c5ccccc5)cc4)cc3)cc21
InChIInChI=1S/C70H50N2/c1-69(2)60-26-12-9-24-56(60)58-43-39-51(45-64(58)69)49-35-33-47(34-36-49)48-37-40-53(41-38-48)71(66-30-16-11-23-55(66)50-19-5-3-6-20-50)54-42-44-59-57-25-10-13-27-61(57)70(65(59)46-54)62-28-14-17-31-67(62)72(52-21-7-4-8-22-52)68-32-18-15-29-63(68)70/h3-46H,1-2H3
InChIKeyTXWVRAMSKPZSNP-UHFFFAOYSA-N
XLogP18.61
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500919.18
LogP ≤ 518.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,9-dimethyl-N-(2-phenylphenyl)-N-[4-(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-phenyl-N-[4-(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)phenyl]fluoren-2-amine;N,N-diphenyl-4-(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)aniline
CID 161259967
N-(9,9-dimethylfluoren-2-yl)-N-(2,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 155240335
10-phenyl-N-(3-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166635
10-phenyl-N,N-bis[2-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166634
9,9-dimethyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-7-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-2-ylfluoren-2-amine
CID 121391735
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-2-yl)-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine;N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-(3-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 158938491
N-(9,9-dimethylfluoren-2-yl)-N,10-diphenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 134309240
N-[4-(9,9-dimethyl-10-phenylacridin-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 58489884
N,N-bis[3-(9,9-dimethylfluoren-2-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-(2-phenylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 157078177
N-[6-[9,9-dimethyl-7-(N-(9-methyl-9-phenylfluoren-2-yl)-2-phenylanilino)fluoren-3-yl]triphenylen-2-yl]-10-phenyl-N-(4-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 138643341
N-(9,9-dimethylfluoren-2-yl)-7'-(1,13-diphenyl-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-yl)-N-phenyl-9,9'-spirobi[fluorene]-2'-amine
CID 168750612

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine?
The IUPAC name of N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine (CID 155240757) is N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine.
What is the SMILES notation for N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine?
The canonical SMILES for N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine is CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc(N(c5ccc6c(c5)C5(c7ccccc7-6)c6ccccc6N(c6ccccc6)c6ccccc65)c5ccccc5-c5ccccc5)cc4)cc3)cc21.
What is the InChIKey of N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine?
The InChIKey is TXWVRAMSKPZSNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H50N2/c1-69(2)60-26-12-9-24-56(60)58-43-39-51(45-64(58)69)49-35-33-47(34-36-49)48-37-40-53(41-38-48)71(66-30-16-11-23-55(66)50-19-5-3-6-20-50)54-42-44-59-57-25-10-13-27-61(57)70(65(59)46-54)62-28-14-17-31-67(62)72(52-21-7-4-8-22-52)68-32-18-15-29-63(68)70/h3-46H,1-2H3.
What are the key properties of N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine?
N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine has a molecular weight of 919.18 g/mol, XLogP of 18.61, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-10-phenyl-N-(2-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 155240757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).