N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine

C9H12Cl3NSi — CID 15371807

IUPACN,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine
SMILESCN(C)Cc1ccccc1[Si](Cl)(Cl)Cl
InChIInChI=1S/C9H12Cl3NSi/c1-13(2)7-8-5-3-4-6-9(8)14(10,11)12/h3-6H,7H2,1-2H3
InChIKeyIZPJNWDBARWXRZ-UHFFFAOYSA-N
MW268.65 g/mol
LogP2.61
Rot. Bonds3

About N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine

N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine (PubChem CID 15371807) has the molecular formula C9H12Cl3NSi and a molecular weight of 268.65 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine
PubChem CID15371807
Molecular FormulaC9H12Cl3NSi
Molecular Weight268.65 g/mol
Exact Mass266.98
IUPAC NameN,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine
SMILESCN(C)Cc1ccccc1[Si](Cl)(Cl)Cl
InChIInChI=1S/C9H12Cl3NSi/c1-13(2)7-8-5-3-4-6-9(8)14(10,11)12/h3-6H,7H2,1-2H3
InChIKeyIZPJNWDBARWXRZ-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.65
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine?
The IUPAC name of N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine (CID 15371807) is N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine is CN(C)Cc1ccccc1[Si](Cl)(Cl)Cl.
What is the InChIKey of N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine?
The InChIKey is IZPJNWDBARWXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl3NSi/c1-13(2)7-8-5-3-4-6-9(8)14(10,11)12/h3-6H,7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine?
N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine has a molecular weight of 268.65 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-trichlorosilylphenyl)methanamine is sourced from PubChem (CID 15371807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).