N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine

C70H50N2 — CID 170138428

IUPACN-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cccc21
InChIInChI=1S/C70H50N2/c1-69(2)61-35-16-13-33-59(61)68-58(34-21-37-64(68)69)56-32-15-18-38-65(56)71(52-29-20-22-47(44-52)48-40-42-57-55-31-14-19-39-66(55)72(67(57)45-48)51-27-10-5-11-28-51)53-41-43-63-60(46-53)54-30-12-17-36-62(54)70(63,49-23-6-3-7-24-49)50-25-8-4-9-26-50/h3-46H,1-2H3
InChIKeyUSCFFLYMKDNTBT-UHFFFAOYSA-N
MW919.18 g/mol
LogP18.26
Rot. Bonds8

About N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine

N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine (PubChem CID 170138428) has the molecular formula C70H50N2 and a molecular weight of 919.18 g/mol. Its IUPAC name is N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine.

Molecular Properties

Compound NameN-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine
PubChem CID170138428
Molecular FormulaC70H50N2
Molecular Weight919.18 g/mol
Exact Mass918.40
IUPAC NameN-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cccc21
InChIInChI=1S/C70H50N2/c1-69(2)61-35-16-13-33-59(61)68-58(34-21-37-64(68)69)56-32-15-18-38-65(56)71(52-29-20-22-47(44-52)48-40-42-57-55-31-14-19-39-66(55)72(67(57)45-48)51-27-10-5-11-28-51)53-41-43-63-60(46-53)54-30-12-17-36-62(54)70(63,49-23-6-3-7-24-49)50-25-8-4-9-26-50/h3-46H,1-2H3
InChIKeyUSCFFLYMKDNTBT-UHFFFAOYSA-N
XLogP18.26
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500919.18
LogP ≤ 518.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-carbazol-9-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-3-amine
CID 170138490
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[2-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 170138277
N-(9,9-dimethylfluoren-3-yl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-7-[6-[3-[N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-9,9-dimethylfluoren-2-yl]-9-phenylcarbazol-3-amine
CID 170142819
2-(9,9-dimethylfluoren-4-yl)-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(2-phenylphenyl)phenyl]aniline
CID 170137615
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9-phenylcarbazol-3-amine
CID 170138253
N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
CID 118505787
N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-4-amine
CID 139567831
N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 139568029
2-(9,9-dimethylfluoren-4-yl)-N-[3-(9,9-dimethylfluoren-3-yl)phenyl]-N-[4-(9,9-diphenylfluoren-3-yl)phenyl]aniline
CID 170142523
N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-4-amine
CID 139567825
N-(3-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9-phenylcarbazol-2-amine
CID 170139036
N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 121423814

Frequently Asked Questions

What is the IUPAC name of N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine?
The IUPAC name of N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine (CID 170138428) is N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine.
What is the SMILES notation for N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine?
The canonical SMILES for N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine is CC1(C)c2ccccc2-c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cccc21.
What is the InChIKey of N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine?
The InChIKey is USCFFLYMKDNTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H50N2/c1-69(2)61-35-16-13-33-59(61)68-58(34-21-37-64(68)69)56-32-15-18-38-65(56)71(52-29-20-22-47(44-52)48-40-42-57-55-31-14-19-39-66(55)72(67(57)45-48)51-27-10-5-11-28-51)53-41-43-63-60(46-53)54-30-12-17-36-62(54)70(63,49-23-6-3-7-24-49)50-25-8-4-9-26-50/h3-46H,1-2H3.
What are the key properties of N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine?
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine has a molecular weight of 919.18 g/mol, XLogP of 18.26, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine is sourced from PubChem (CID 170138428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).