N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine

C56H41N — CID 168798213

IUPACN-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3ccccc3C3c4ccccc4-c4ccccc43)cc21
InChIInChI=1S/C56H41N/c1-56(2)51-28-12-10-22-46(51)47-35-34-41(36-52(47)56)57(53-29-13-11-25-50(53)55-48-23-8-6-20-44(48)45-21-7-9-24-49(45)55)40-32-30-38(31-33-40)43-27-15-19-39-18-14-26-42(54(39)43)37-16-4-3-5-17-37/h3-36,55H,1-2H3
InChIKeyOHHFZRWNBAQSMO-UHFFFAOYSA-N
MW727.95 g/mol
LogP15.11
Rot. Bonds6

About N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine

N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine (PubChem CID 168798213) has the molecular formula C56H41N and a molecular weight of 727.95 g/mol. Its IUPAC name is N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
PubChem CID168798213
Molecular FormulaC56H41N
Molecular Weight727.95 g/mol
Exact Mass727.32
IUPAC NameN-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3ccccc3C3c4ccccc4-c4ccccc43)cc21
InChIInChI=1S/C56H41N/c1-56(2)51-28-12-10-22-46(51)47-35-34-41(36-52(47)56)57(53-29-13-11-25-50(53)55-48-23-8-6-20-44(48)45-21-7-9-24-49(45)55)40-32-30-38(31-33-40)43-27-15-19-39-18-14-26-42(54(39)43)37-16-4-3-5-17-37/h3-36,55H,1-2H3
InChIKeyOHHFZRWNBAQSMO-UHFFFAOYSA-N
XLogP15.11
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 ≤ 515.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine with MolForge

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Related Compounds

5-(9H-fluoren-9-yl)-9,9-dimethyl-N-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 142604920
9,9-dimethyl-N-phenyl-N-[3-(9-phenyl-9H-fluoren-2-yl)phenyl]fluoren-2-amine
CID 144639598
9,9-dimethyl-N-[4-[4-[4-(N-naphthalen-1-ylanilino)phenyl]-2,5-diphenylphenyl]phenyl]-N-phenylfluoren-2-amine
CID 176611486
9,9-dimethyl-N-(4-phenanthren-4-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 118368668
9,9-dimethyl-N-naphthalen-1-yl-N-[4-[5-(N-naphthalen-1-ylanilino)naphthalen-1-yl]phenyl]fluoren-2-amine
CID 59221637
7,7-dimethyl-1-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)benzo[a]phenalen-9-amine
CID 167232028
1-N-(9,9-dimethylfluoren-2-yl)-4-N-naphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 59025130
N-[2-[8-(3,5-ditert-butylphenyl)naphthalen-1-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 170293567
9,9-dimethyl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 166566031
9,9-dimethyl-N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 139352574
N-(3,5-ditert-butylphenyl)-9,9-dimethyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170291586
9,9-dimethyl-N,N-bis(2-phenylphenyl)fluoren-2-amine
CID 118245783

Frequently Asked Questions

What is the IUPAC name of N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The IUPAC name of N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine (CID 168798213) is N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The canonical SMILES for N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5cccc(-c6ccccc6)c45)cc3)c3ccccc3C3c4ccccc4-c4ccccc43)cc21.
What is the InChIKey of N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The InChIKey is OHHFZRWNBAQSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41N/c1-56(2)51-28-12-10-22-46(51)47-35-34-41(36-52(47)56)57(53-29-13-11-25-50(53)55-48-23-8-6-20-44(48)45-21-7-9-24-49(45)55)40-32-30-38(31-33-40)43-27-15-19-39-18-14-26-42(54(39)43)37-16-4-3-5-17-37/h3-36,55H,1-2H3.
What are the key properties of N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine has a molecular weight of 727.95 g/mol, XLogP of 15.11, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(9H-fluoren-9-yl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 168798213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).