N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine

C52H39GeNO — CID 140704675

IUPACN-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine
SMILESc1ccc(Oc2ccc(N(c3ccc(-c4ccc([Ge](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C52H39GeNO/c1-5-18-43(19-6-1)53(44-20-7-2-8-21-44,45-22-9-3-10-23-45)46-32-28-40(29-33-46)41-30-34-47(35-31-41)54(52-27-15-17-42-16-13-14-26-51(42)52)48-36-38-50(39-37-48)55-49-24-11-4-12-25-49/h1-39H
InChIKeyWAGDWDJNQHYXDI-UHFFFAOYSA-N
MW766.50 g/mol
LogP11.15
Rot. Bonds10

About N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine

N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine (PubChem CID 140704675) has the molecular formula C52H39GeNO and a molecular weight of 766.50 g/mol. Its IUPAC name is N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine
PubChem CID140704675
Molecular FormulaC52H39GeNO
Molecular Weight766.50 g/mol
Exact Mass767.22
IUPAC NameN-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine
SMILESc1ccc(Oc2ccc(N(c3ccc(-c4ccc([Ge](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C52H39GeNO/c1-5-18-43(19-6-1)53(44-20-7-2-8-21-44,45-22-9-3-10-23-45)46-32-28-40(29-33-46)41-30-34-47(35-31-41)54(52-27-15-17-42-16-13-14-26-51(42)52)48-36-38-50(39-37-48)55-49-24-11-4-12-25-49/h1-39H
InChIKeyWAGDWDJNQHYXDI-UHFFFAOYSA-N
XLogP11.15
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms55
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500766.50
LogP ≤ 511.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine?
The IUPAC name of N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine (CID 140704675) is N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine.
What is the SMILES notation for N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine?
The canonical SMILES for N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine is c1ccc(Oc2ccc(N(c3ccc(-c4ccc([Ge](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine?
The InChIKey is WAGDWDJNQHYXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H39GeNO/c1-5-18-43(19-6-1)53(44-20-7-2-8-21-44,45-22-9-3-10-23-45)46-32-28-40(29-33-46)41-30-34-47(35-31-41)54(52-27-15-17-42-16-13-14-26-51(42)52)48-36-38-50(39-37-48)55-49-24-11-4-12-25-49/h1-39H.
What are the key properties of N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine?
N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine has a molecular weight of 766.50 g/mol, XLogP of 11.15, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenoxyphenyl)-N-[4-(4-triphenylgermylphenyl)phenyl]naphthalen-1-amine is sourced from PubChem (CID 140704675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).