10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine

C43H35NSi — CID 59861207

IUPAC10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine
SMILESC[Si](C)(C)c1ccc(N(c2ccccc2)c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c2ccccc12
InChIInChI=1S/C43H35NSi/c1-45(2,3)41-29-28-40(33-21-9-10-22-34(33)41)44(31-18-5-4-6-19-31)43-38-25-13-11-23-36(38)42(37-24-12-14-26-39(37)43)35-27-15-17-30-16-7-8-20-32(30)35/h4-29H,1-3H3
InChIKeyBOQFIFNDADPVEK-UHFFFAOYSA-N
MW593.85 g/mol
LogP11.98
Rot. Bonds5

About 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine

10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine (PubChem CID 59861207) has the molecular formula C43H35NSi and a molecular weight of 593.85 g/mol. Its IUPAC name is 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine.

Molecular Properties

Compound Name10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine
PubChem CID59861207
Molecular FormulaC43H35NSi
Molecular Weight593.85 g/mol
Exact Mass593.25
IUPAC Name10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine
SMILESC[Si](C)(C)c1ccc(N(c2ccccc2)c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c2ccccc12
InChIInChI=1S/C43H35NSi/c1-45(2,3)41-29-28-40(33-21-9-10-22-34(33)41)44(31-18-5-4-6-19-31)43-38-25-13-11-23-36(38)42(37-24-12-14-26-39(37)43)35-27-15-17-30-16-7-8-20-32(30)35/h4-29H,1-3H3
InChIKeyBOQFIFNDADPVEK-UHFFFAOYSA-N
XLogP11.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500593.85
LogP ≤ 511.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

10-naphthalen-1-yl-N-phenyl-N-(2-phenylphenyl)phenanthren-9-amine
CID 155303869
N-naphthalen-1-yl-N-phenylpentacyclo[10.7.1.02,7.08,20.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaen-13-amine
CID 23534512
9-N,10-N-dinaphthalen-1-yl-9-N,10-N-diphenylanthracene-9,10-diamine
CID 20665521
1-naphthalen-1-yl-N,N-diphenylnaphthalen-2-amine
CID 163843201
3-(10-naphthalen-1-ylanthracen-9-yl)-N,N-diphenylaniline
CID 164717619
N-(4-methylnaphthalen-1-yl)-10-[10-(N-(4-methylnaphthalen-1-yl)anilino)anthracen-9-yl]-N-phenylanthracen-9-amine
CID 121444405
6-(N-(10-naphthalen-1-ylanthracen-9-yl)anilino)pyridine-2-carbonitrile
CID 59390749
4-[4-(N-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]anilino)phenyl]-N,N-diphenylaniline
CID 59221810
10-naphthalen-1-yl-N-(2-phenylphenyl)-N-(3-phenylphenyl)phenanthren-9-amine
CID 155305179
1-naphthalen-1-yl-N-phenyl-N-(2-phenylphenyl)naphthalen-2-amine
CID 164774553
N-phenyl-N-[4-[10-(4-phenyl-N-(4-phenylphenyl)anilino)anthracen-9-yl]naphthalen-1-yl]-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-amine
CID 153468524
N-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-N-phenylisoquinolin-1-amine
CID 59390724

Frequently Asked Questions

What is the IUPAC name of 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine?
The IUPAC name of 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine (CID 59861207) is 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine.
What is the SMILES notation for 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine?
The canonical SMILES for 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine is C[Si](C)(C)c1ccc(N(c2ccccc2)c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c2ccccc12.
What is the InChIKey of 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine?
The InChIKey is BOQFIFNDADPVEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H35NSi/c1-45(2,3)41-29-28-40(33-21-9-10-22-34(33)41)44(31-18-5-4-6-19-31)43-38-25-13-11-23-36(38)42(37-24-12-14-26-39(37)43)35-27-15-17-30-16-7-8-20-32(30)35/h4-29H,1-3H3.
What are the key properties of 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine?
10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine has a molecular weight of 593.85 g/mol, XLogP of 11.98, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-naphthalen-1-yl-N-phenyl-N-(4-trimethylsilylnaphthalen-1-yl)anthracen-9-amine is sourced from PubChem (CID 59861207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).