10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine

C52H41N — CID 171402161

IUPAC10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine
SMILESCC1(C)c2ccccc2-c2c1cc1c(c2-c2ccccc2)-c2ccc(N(c3ccc4ccccc4c3)c3ccccc3-c3ccccc3)cc2C1(C)C
InChIInChI=1S/C52H41N/c1-51(2)43-25-15-13-24-41(43)49-45(51)33-46-50(48(49)36-20-9-6-10-21-36)42-30-29-39(32-44(42)52(46,3)4)53(38-28-27-34-17-11-12-22-37(34)31-38)47-26-16-14-23-40(47)35-18-7-5-8-19-35/h5-33H,1-4H3
InChIKeyZEQTVIYUNCIOFN-UHFFFAOYSA-N
MW679.91 g/mol
LogP14.26
Rot. Bonds5

About 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine

10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine (PubChem CID 171402161) has the molecular formula C52H41N and a molecular weight of 679.91 g/mol. Its IUPAC name is 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine.

Molecular Properties

Compound Name10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine
PubChem CID171402161
Molecular FormulaC52H41N
Molecular Weight679.91 g/mol
Exact Mass679.32
IUPAC Name10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine
SMILESCC1(C)c2ccccc2-c2c1cc1c(c2-c2ccccc2)-c2ccc(N(c3ccc4ccccc4c3)c3ccccc3-c3ccccc3)cc2C1(C)C
InChIInChI=1S/C52H41N/c1-51(2)43-25-15-13-24-41(43)49-45(51)33-46-50(48(49)36-20-9-6-10-21-36)42-30-29-39(32-44(42)52(46,3)4)53(38-28-27-34-17-11-12-22-37(34)31-38)47-26-16-14-23-40(47)35-18-7-5-8-19-35/h5-33H,1-4H3
InChIKeyZEQTVIYUNCIOFN-UHFFFAOYSA-N
XLogP14.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500679.91
LogP ≤ 514.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-naphthalen-2-yl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121321797
10,10,12,12-tetramethyl-N,5-diphenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-7-amine
CID 171402249
9,9-dimethyl-N,7-dinaphthalen-2-yl-N-(2-phenylphenyl)fluoren-2-amine
CID 121321537
7,7-dimethyl-1-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)benzo[a]phenalen-9-amine
CID 167232028
9,9-dimethyl-N-[2-[4-[4-[naphthalen-2-yl-(1-phenylnaphthalen-2-yl)amino]phenyl]phenyl]phenyl]-N-phenylfluoren-2-amine
CID 176611810
9,9-dimethyl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 166566031
9,9-dimethyl-N,N-bis(2-phenylphenyl)fluoren-2-amine
CID 118245783
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-naphthalen-2-yl-3-phenylfluoren-2-amine
CID 178165633
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 170142242
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]naphthalen-2-amine
CID 170135293
N-[9,9-dimethyl-7-[4-(4-phenylphenyl)phenyl]fluoren-2-yl]-N-(2-phenylphenyl)anthracen-2-amine
CID 121321764
9,9-dimethyl-N-naphthalen-2-yl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
CID 170303411

Frequently Asked Questions

What is the IUPAC name of 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine?
The IUPAC name of 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine (CID 171402161) is 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine.
What is the SMILES notation for 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine?
The canonical SMILES for 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine is CC1(C)c2ccccc2-c2c1cc1c(c2-c2ccccc2)-c2ccc(N(c3ccc4ccccc4c3)c3ccccc3-c3ccccc3)cc2C1(C)C.
What is the InChIKey of 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine?
The InChIKey is ZEQTVIYUNCIOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H41N/c1-51(2)43-25-15-13-24-41(43)49-45(51)33-46-50(48(49)36-20-9-6-10-21-36)42-30-29-39(32-44(42)52(46,3)4)53(38-28-27-34-17-11-12-22-37(34)31-38)47-26-16-14-23-40(47)35-18-7-5-8-19-35/h5-33H,1-4H3.
What are the key properties of 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine?
10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine has a molecular weight of 679.91 g/mol, XLogP of 14.26, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10,12,12-tetramethyl-N-naphthalen-2-yl-5-phenyl-N-(2-phenylphenyl)indeno[2,1-b]fluoren-8-amine is sourced from PubChem (CID 171402161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).