N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline

C36H33N — CID 134551611

IUPACN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline
SMILESCC(C)N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C36H33N/c1-25(2)37(35-17-11-9-14-30(35)27-12-6-5-7-13-27)29-21-18-26(19-22-29)28-20-23-32-31-15-8-10-16-33(31)36(3,4)34(32)24-28/h5-25H,1-4H3
InChIKeyILIKVINDSCNQJX-UHFFFAOYSA-N
MW479.67 g/mol
LogP9.87
Rot. Bonds5

About N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline

N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline (PubChem CID 134551611) has the molecular formula C36H33N and a molecular weight of 479.67 g/mol. Its IUPAC name is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline.

Molecular Properties

Compound NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline
PubChem CID134551611
Molecular FormulaC36H33N
Molecular Weight479.67 g/mol
Exact Mass479.26
IUPAC NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline
SMILESCC(C)N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C36H33N/c1-25(2)37(35-17-11-9-14-30(35)27-12-6-5-7-13-27)29-21-18-26(19-22-29)28-20-23-32-31-15-8-10-16-33(31)36(3,4)34(32)24-28/h5-25H,1-4H3
InChIKeyILIKVINDSCNQJX-UHFFFAOYSA-N
XLogP9.87
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.67
LogP ≤ 59.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-propan-2-ylaniline
CID 59307898
9,9-dimethyl-N,7-diphenyl-N-propan-2-ylfluoren-2-amine
CID 134509907
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-3,5-dimethyl-N-propan-2-ylaniline
CID 59307879
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-propan-2-ylfluoren-2-amine;9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)-N-propan-2-ylfluoren-2-amine;9,9-dimethyl-N-(3-naphthalen-1-ylphenyl)-N-propan-2-ylfluoren-2-amine
CID 158936779
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-phenyl-5-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 164529236
N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline
CID 59757697
N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-(4-phenylphenyl)aniline;4-(9,9-dimethylfluoren-2-yl)-N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,4-diphenylaniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-(2-phenylphenyl)-N,N-bis[4-(2-phenylphenyl)phenyl]aniline
CID 159257633
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylaniline
CID 146576437
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121321797
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-3-phenyl-2-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 168788736
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118146254
9,9-dimethyl-N,N-bis(2-phenylphenyl)fluoren-2-amine
CID 118245783

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline?
The IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline (CID 134551611) is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline.
What is the SMILES notation for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline?
The canonical SMILES for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline is CC(C)N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1ccccc1-c1ccccc1.
What is the InChIKey of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline?
The InChIKey is ILIKVINDSCNQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H33N/c1-25(2)37(35-17-11-9-14-30(35)27-12-6-5-7-13-27)29-21-18-26(19-22-29)28-20-23-32-31-15-8-10-16-33(31)36(3,4)34(32)24-28/h5-25H,1-4H3.
What are the key properties of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline?
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline has a molecular weight of 479.67 g/mol, XLogP of 9.87, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-N-propan-2-ylaniline is sourced from PubChem (CID 134551611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).