9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine

C39H31N — CID 134528915

IUPAC9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(Nc3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc21
InChIInChI=1S/C39H31N/c1-39(2)37-11-7-6-10-35(37)36-25-24-34(26-38(36)39)40-33-22-20-32(21-23-33)31-18-16-30(17-19-31)29-14-12-28(13-15-29)27-8-4-3-5-9-27/h3-26,40H,1-2H3
InChIKeyPYRMAAIFFPQABM-UHFFFAOYSA-N
MW513.68 g/mol
LogP10.74
Rot. Bonds5

About 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine

9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine (PubChem CID 134528915) has the molecular formula C39H31N and a molecular weight of 513.68 g/mol. Its IUPAC name is 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
PubChem CID134528915
Molecular FormulaC39H31N
Molecular Weight513.68 g/mol
Exact Mass513.25
IUPAC Name9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(Nc3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc21
InChIInChI=1S/C39H31N/c1-39(2)37-11-7-6-10-35(37)36-25-24-34(26-38(36)39)40-33-22-20-32(21-23-33)31-18-16-30(17-19-31)29-14-12-28(13-15-29)27-8-4-3-5-9-27/h3-26,40H,1-2H3
InChIKeyPYRMAAIFFPQABM-UHFFFAOYSA-N
XLogP10.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.68
LogP ≤ 510.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160556555
9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 59357506
N-(4-phenylphenyl)-9,9-bis(trideuteriomethyl)fluoren-2-amine
CID 155619972
N-[4-(4-fluorophenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 167260406
4-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;ethane
CID 143972766
9,9-dimethyl-N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-2-amine
CID 177113997
N-(9,9-dimethylfluoren-2-yl)-9,9,10,10-tetramethylanthracen-2-amine
CID 166647046
1-bromo-4-(4-bromophenyl)benzene;N-[4-(4-bromophenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158338012
CID 144628230
CID 144628230
N-(4-dibenzo-p-dioxin-2-ylphenyl)-9,9-dimethylfluoren-2-amine
CID 126629843
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-2-amine
CID 70891334
9,9-dimethyl-7-(1-methylcyclopropyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 144671031

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine (CID 134528915) is 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(Nc3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc21.
What is the InChIKey of 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine?
The InChIKey is PYRMAAIFFPQABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H31N/c1-39(2)37-11-7-6-10-35(37)36-25-24-34(26-38(36)39)40-33-22-20-32(21-23-33)31-18-16-30(17-19-31)29-14-12-28(13-15-29)27-8-4-3-5-9-27/h3-26,40H,1-2H3.
What are the key properties of 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine?
9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine has a molecular weight of 513.68 g/mol, XLogP of 10.74, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine is sourced from PubChem (CID 134528915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).