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

C45H35N — CID 135245500

IUPACN-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine
SMILESCN(c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2)C(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C45H35N/c1-46(44(35-18-8-3-9-19-35)36-28-26-34(27-29-36)33-16-6-2-7-17-33)39-30-31-41-40-24-14-15-25-42(40)45(43(41)32-39,37-20-10-4-11-21-37)38-22-12-5-13-23-38/h2-32,44H,1H3
InChIKeyVUPWLPFIPMSGTJ-UHFFFAOYSA-N
MW589.78 g/mol
LogP10.94
Rot. Bonds7

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

N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine (PubChem CID 135245500) has the molecular formula C45H35N and a molecular weight of 589.78 g/mol. Its IUPAC name is N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine.

Molecular Properties

Compound NameN-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine
PubChem CID135245500
Molecular FormulaC45H35N
Molecular Weight589.78 g/mol
Exact Mass589.28
IUPAC NameN-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine
SMILESCN(c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2)C(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C45H35N/c1-46(44(35-18-8-3-9-19-35)36-28-26-34(27-29-36)33-16-6-2-7-17-33)39-30-31-41-40-24-14-15-25-42(40)45(43(41)32-39,37-20-10-4-11-21-37)38-22-12-5-13-23-38/h2-32,44H,1H3
InChIKeyVUPWLPFIPMSGTJ-UHFFFAOYSA-N
XLogP10.94
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500589.78
LogP ≤ 510.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-diphenylfluoren-2-yl)-N-methyl-9,9-diphenylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-methyl-9,9'-spirobi[fluorene]-2-amine;N-methyl-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-methyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 160501887
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N-(9,9-diphenylfluoren-2-yl)-N-methyl-9,9'-spirobi[fluorene]-2-amine
CID 160501888
N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-amine
CID 118298327
N-(9,9-diphenylfluoren-2-yl)-9,9-diphenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 118298160
N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)-9-(4-propan-2-ylphenyl)fluoren-2-amine
CID 177067063
9,9-dimethyl-N-(4-phenylphenyl)-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]fluoren-2-amine
CID 163787902
N-(2,6-dimethyl-4-phenylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118298346
N-[4-[4-[(9,9-diphenylfluoren-2-yl)-naphthalen-2-ylamino]phenyl]phenyl]-N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine
CID 122448831
9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-phenylfluoren-3-yl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 177067075
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 118298338

Frequently Asked Questions

What is the IUPAC name of N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine?
The IUPAC name of N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine (CID 135245500) is N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine.
What is the SMILES notation for N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine?
The canonical SMILES for N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine is CN(c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2)C(c1ccccc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine?
The InChIKey is VUPWLPFIPMSGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H35N/c1-46(44(35-18-8-3-9-19-35)36-28-26-34(27-29-36)33-16-6-2-7-17-33)39-30-31-41-40-24-14-15-25-42(40)45(43(41)32-39,37-20-10-4-11-21-37)38-22-12-5-13-23-38/h2-32,44H,1H3.
What are the key properties of N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine?
N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine has a molecular weight of 589.78 g/mol, XLogP of 10.94, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-9,9-diphenyl-N-[phenyl-(4-phenylphenyl)methyl]fluoren-2-amine is sourced from PubChem (CID 135245500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).