4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine

C12H15ClN4Si — CID 165353239

IUPAC4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine
SMILESC[Si](C)(C)c1ccc(-c2nc(N)nc(Cl)n2)cc1
InChIInChI=1S/C12H15ClN4Si/c1-18(2,3)9-6-4-8(5-7-9)10-15-11(13)17-12(14)16-10/h4-7H,1-3H3,(H2,14,15,16,17)
InChIKeyQFSVZKWTVGIHKR-UHFFFAOYSA-N
MW278.82 g/mol
LogP2.32
Rot. Bonds2

About 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine

4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine (PubChem CID 165353239) has the molecular formula C12H15ClN4Si and a molecular weight of 278.82 g/mol. Its IUPAC name is 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine
PubChem CID165353239
Molecular FormulaC12H15ClN4Si
Molecular Weight278.82 g/mol
Exact Mass278.08
IUPAC Name4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine
SMILESC[Si](C)(C)c1ccc(-c2nc(N)nc(Cl)n2)cc1
InChIInChI=1S/C12H15ClN4Si/c1-18(2,3)9-6-4-8(5-7-9)10-15-11(13)17-12(14)16-10/h4-7H,1-3H3,(H2,14,15,16,17)
InChIKeyQFSVZKWTVGIHKR-UHFFFAOYSA-N
XLogP2.32
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.82
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine (CID 165353239) is 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine is C[Si](C)(C)c1ccc(-c2nc(N)nc(Cl)n2)cc1.
What is the InChIKey of 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine?
The InChIKey is QFSVZKWTVGIHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN4Si/c1-18(2,3)9-6-4-8(5-7-9)10-15-11(13)17-12(14)16-10/h4-7H,1-3H3,(H2,14,15,16,17).
What are the key properties of 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine?
4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine has a molecular weight of 278.82 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(4-trimethylsilylphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 165353239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).