N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine

C55H44N2Si — CID 58121632

IUPACN-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine
SMILESCc1cccc(N(c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc2)c2ccc([Si](C)(C)C)cc2)n1
InChIInChI=1S/C55H44N2Si/c1-37-12-11-19-53(56-37)57(47-29-31-48(32-30-47)58(2,3)4)46-27-24-40(25-28-46)43-26-33-51-52(36-43)55(45-23-21-39-14-6-8-16-42(39)35-45)50-18-10-9-17-49(50)54(51)44-22-20-38-13-5-7-15-41(38)34-44/h5-36H,1-4H3
InChIKeyOMRFRJPFVLVFPU-UHFFFAOYSA-N
MW761.06 g/mol
LogP15.02
Rot. Bonds7

About N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine

N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine (PubChem CID 58121632) has the molecular formula C55H44N2Si and a molecular weight of 761.06 g/mol. Its IUPAC name is N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine.

Molecular Properties

Compound NameN-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine
PubChem CID58121632
Molecular FormulaC55H44N2Si
Molecular Weight761.06 g/mol
Exact Mass760.33
IUPAC NameN-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine
SMILESCc1cccc(N(c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc2)c2ccc([Si](C)(C)C)cc2)n1
InChIInChI=1S/C55H44N2Si/c1-37-12-11-19-53(56-37)57(47-29-31-48(32-30-47)58(2,3)4)46-27-24-40(25-28-46)43-26-33-51-52(36-43)55(45-23-21-39-14-6-8-16-42(39)35-45)50-18-10-9-17-49(50)54(51)44-22-20-38-13-5-7-15-41(38)34-44/h5-36H,1-4H3
InChIKeyOMRFRJPFVLVFPU-UHFFFAOYSA-N
XLogP15.02
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500761.06
LogP ≤ 515.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-N-phenylpyridin-2-amine
CID 58121682
N-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-6-methyl-N-phenylpyridin-2-amine
CID 59390738
trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane
CID 58151270
4-(9,10-dinaphthalen-2-ylanthracen-2-yl)-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]aniline;9,10-dinaphthalen-2-yl-2,6-bis(10-naphthalen-2-ylanthracen-9-yl)anthracene;9,10-dinaphthalen-2-yl-2,6-bis(10-phenylanthracen-9-yl)anthracene
CID 159179813
trimethyl-[4-[10-[4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracen-9-yl]phenyl]silane
CID 59024575
9,10-dinaphthalen-2-yl-2-(4-naphthalen-2-ylphenyl)anthracene
CID 59136606
trimethyl-(10-naphthalen-2-yl-9-phenylanthracen-2-yl)silane
CID 123999197
N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline
CID 59194308
2-N,6-N-bis(4-methylphenyl)-9,10-dinaphthalen-2-yl-2-N,6-N-di(quinolin-2-yl)anthracene-2,6-diamine
CID 58855241
trimethyl-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]silane
CID 171056374
2-methyl-6-[10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]anthracen-9-yl]pyridine
CID 58894807
N-[4-[9,10-dinaphthalen-2-yl-6-[4-[pyridin-2-yl(quinolin-2-yl)amino]phenyl]anthracen-2-yl]phenyl]-N-pyridin-2-ylquinolin-2-amine
CID 58121678

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine?
The IUPAC name of N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine (CID 58121632) is N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine.
What is the SMILES notation for N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine?
The canonical SMILES for N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine is Cc1cccc(N(c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc2)c2ccc([Si](C)(C)C)cc2)n1.
What is the InChIKey of N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine?
The InChIKey is OMRFRJPFVLVFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H44N2Si/c1-37-12-11-19-53(56-37)57(47-29-31-48(32-30-47)58(2,3)4)46-27-24-40(25-28-46)43-26-33-51-52(36-43)55(45-23-21-39-14-6-8-16-42(39)35-45)50-18-10-9-17-49(50)54(51)44-22-20-38-13-5-7-15-41(38)34-44/h5-36H,1-4H3.
What are the key properties of N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine?
N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine has a molecular weight of 761.06 g/mol, XLogP of 15.02, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-6-methyl-N-(4-trimethylsilylphenyl)pyridin-2-amine is sourced from PubChem (CID 58121632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).