11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine

C43H33N — CID 170372991

IUPAC11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)c3ccccc3c21
InChIInChI=1S/C43H33N/c1-43(2)39-28-32(30-16-6-3-7-17-30)26-27-35(39)38-29-41(36-23-12-13-24-37(36)42(38)43)44(33-20-10-5-11-21-33)40-25-15-14-22-34(40)31-18-8-4-9-19-31/h3-29H,1-2H3
InChIKeyJKOGRCZKTNTGAS-UHFFFAOYSA-N
MW563.74 g/mol
LogP11.95
Rot. Bonds5

About 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine

11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine (PubChem CID 170372991) has the molecular formula C43H33N and a molecular weight of 563.74 g/mol. Its IUPAC name is 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine.

Molecular Properties

Compound Name11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine
PubChem CID170372991
Molecular FormulaC43H33N
Molecular Weight563.74 g/mol
Exact Mass563.26
IUPAC Name11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)c3ccccc3c21
InChIInChI=1S/C43H33N/c1-43(2)39-28-32(30-16-6-3-7-17-30)26-27-35(39)38-29-41(36-23-12-13-24-37(36)42(38)43)44(33-20-10-5-11-21-33)40-25-15-14-22-34(40)31-18-8-4-9-19-31/h3-29H,1-2H3
InChIKeyJKOGRCZKTNTGAS-UHFFFAOYSA-N
XLogP11.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.74
LogP ≤ 511.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

11,11-dimethyl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)benzo[a]fluoren-5-amine
CID 170373009
8-(9,9-dimethylfluoren-2-yl)-11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-5-amine
CID 170373636
N-[2-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-N,4-diphenylnaphthalen-1-amine
CID 166987766
9,9-dimethyl-7-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-7-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-7-(2-phenylphenyl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 159012836
N,8,11,11-tetraphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine
CID 170373494
N-[4-[6-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-yl]phenyl]-N,2-diphenylaniline
CID 167527111
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(3-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)aniline
CID 167324461
11,11-dimethyl-5-phenyl-N-(4-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]benzo[a]fluoren-8-amine
CID 170372841
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-(3-naphthalen-1-ylphenyl)phenyl]-2-phenylaniline
CID 168846073
2-(9,9-dimethylfluoren-1-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]aniline
CID 170218393
6,6,12,12-tetramethyl-7,9-diphenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)indeno[1,2-b]fluoren-2-amine
CID 138455841
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

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine?
The IUPAC name of 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine (CID 170372991) is 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine.
What is the SMILES notation for 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine?
The canonical SMILES for 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine is CC1(C)c2cc(-c3ccccc3)ccc2-c2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)c3ccccc3c21.
What is the InChIKey of 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine?
The InChIKey is JKOGRCZKTNTGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H33N/c1-43(2)39-28-32(30-16-6-3-7-17-30)26-27-35(39)38-29-41(36-23-12-13-24-37(36)42(38)43)44(33-20-10-5-11-21-33)40-25-15-14-22-34(40)31-18-8-4-9-19-31/h3-29H,1-2H3.
What are the key properties of 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine?
11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine has a molecular weight of 563.74 g/mol, XLogP of 11.95, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-N,9-diphenyl-N-(2-phenylphenyl)benzo[a]fluoren-5-amine is sourced from PubChem (CID 170372991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).