7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine

C56H41N — CID 169293026

IUPAC7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine
SMILESCC1(C)c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc54)cc3)cc2-c2c1ccc1ccccc21
InChIInChI=1S/C56H41N/c1-55(2)49-36-34-43(37-48(49)54-45-23-10-9-17-38(45)31-35-52(54)55)57(42-20-7-4-8-21-42)53-28-16-13-22-44(53)39-29-32-41(33-30-39)56(40-18-5-3-6-19-40)50-26-14-11-24-46(50)47-25-12-15-27-51(47)56/h3-37H,1-2H3
InChIKeyNGWIYXLBORPZJS-UHFFFAOYSA-N
MW727.95 g/mol
LogP14.65
Rot. Bonds6

About 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine

7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine (PubChem CID 169293026) has the molecular formula C56H41N and a molecular weight of 727.95 g/mol. Its IUPAC name is 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine.

Molecular Properties

Compound Name7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine
PubChem CID169293026
Molecular FormulaC56H41N
Molecular Weight727.95 g/mol
Exact Mass727.32
IUPAC Name7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine
SMILESCC1(C)c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc54)cc3)cc2-c2c1ccc1ccccc21
InChIInChI=1S/C56H41N/c1-55(2)49-36-34-43(37-48(49)54-45-23-10-9-17-38(45)31-35-52(54)55)57(42-20-7-4-8-21-42)53-28-16-13-22-44(53)39-29-32-41(33-30-39)56(40-18-5-3-6-19-40)50-26-14-11-24-46(50)47-25-12-15-27-51(47)56/h3-37H,1-2H3
InChIKeyNGWIYXLBORPZJS-UHFFFAOYSA-N
XLogP14.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500727.95
LogP ≤ 514.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-naphthalen-1-ylfluoren-3-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-[2-(4-phenylphenyl)phenyl]fluoren-3-amine
CID 159359844
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-6-(9-phenylfluoren-9-yl)fluoren-3-amine
CID 140919922
9,9-dimethyl-N-naphthalen-1-yl-N-[4-phenyl-3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]fluoren-2-amine
CID 169292946
N-(9,9-dimethylfluoren-4-yl)-N-phenanthren-2-ylphenanthren-2-amine;N,N-di(phenanthren-2-yl)phenanthren-2-amine;N-phenanthren-2-yl-N-phenanthren-4-ylphenanthren-2-amine;N-phenanthren-2-yl-N-[4-(9-phenylfluoren-9-yl)phenyl]phenanthren-2-amine;N-phenanthren-2-yl-N-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenanthren-2-amine;N-phenanthren-2-yl-N-[2-(4-phenylphenyl)phenyl]phenanthren-2-amine
CID 163773436
N-(7,7-dimethylbenzo[c]fluoren-2-yl)-7,7-dimethyl-N-(4-phenylphenyl)benzo[g]fluoren-9-amine;N-(7,7-dimethylbenzo[c]fluoren-2-yl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-2-yl)-7,7-dimethyl-N-(4-phenylphenyl)benzo[c]fluoren-2-amine
CID 159928886
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-5-phenyl-N-(2-phenylphenyl)fluoren-3-amine
CID 169039673
N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine
CID 146364238
N-(4-benzo[c]phenanthren-5-ylphenyl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-3-amine
CID 167182689
N-[4-[4-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]phenyl]-N,2-diphenylaniline
CID 135299735
9,9-dimethyl-N-[2-(5-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]-N-(4-phenylphenyl)fluoren-3-amine
CID 177100674
N-(9,9-dimethylfluoren-4-yl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-3-amine
CID 134487997
N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-3-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158470030

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine?
The IUPAC name of 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine (CID 169293026) is 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine.
What is the SMILES notation for 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine?
The canonical SMILES for 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine is CC1(C)c2ccc(N(c3ccccc3)c3ccccc3-c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc54)cc3)cc2-c2c1ccc1ccccc21.
What is the InChIKey of 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine?
The InChIKey is NGWIYXLBORPZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41N/c1-55(2)49-36-34-43(37-48(49)54-45-23-10-9-17-38(45)31-35-52(54)55)57(42-20-7-4-8-21-42)53-28-16-13-22-44(53)39-29-32-41(33-30-39)56(40-18-5-3-6-19-40)50-26-14-11-24-46(50)47-25-12-15-27-51(47)56/h3-37H,1-2H3.
What are the key properties of 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine?
7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine has a molecular weight of 727.95 g/mol, XLogP of 14.65, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine is sourced from PubChem (CID 169293026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).