N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline

C18H25NOSi — CID 122400860

IUPACN,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline
SMILESCN(C)c1ccc(-c2ccc(CO[Si](C)(C)C)cc2)cc1
InChIInChI=1S/C18H25NOSi/c1-19(2)18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-20-21(3,4)5/h6-13H,14H2,1-5H3
InChIKeyMVUROYHUDPENJS-UHFFFAOYSA-N
MW299.49 g/mol
LogP4.77
Rot. Bonds5

About N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline

N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline (PubChem CID 122400860) has the molecular formula C18H25NOSi and a molecular weight of 299.49 g/mol. Its IUPAC name is N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline
PubChem CID122400860
Molecular FormulaC18H25NOSi
Molecular Weight299.49 g/mol
Exact Mass299.17
IUPAC NameN,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline
SMILESCN(C)c1ccc(-c2ccc(CO[Si](C)(C)C)cc2)cc1
InChIInChI=1S/C18H25NOSi/c1-19(2)18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-20-21(3,4)5/h6-13H,14H2,1-5H3
InChIKeyMVUROYHUDPENJS-UHFFFAOYSA-N
XLogP4.77
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.49
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline?
The IUPAC name of N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline (CID 122400860) is N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline.
What is the SMILES notation for N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline?
The canonical SMILES for N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline is CN(C)c1ccc(-c2ccc(CO[Si](C)(C)C)cc2)cc1.
What is the InChIKey of N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline?
The InChIKey is MVUROYHUDPENJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NOSi/c1-19(2)18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-20-21(3,4)5/h6-13H,14H2,1-5H3.
What are the key properties of N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline?
N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline has a molecular weight of 299.49 g/mol, XLogP of 4.77, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[4-(trimethylsilyloxymethyl)phenyl]aniline is sourced from PubChem (CID 122400860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).