N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine

C17H23ClN2O2Si — CID 141340384

IUPACN-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine
SMILESC[Si](C)(C)CCOCOc1cccc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C17H23ClN2O2Si/c1-23(2,3)12-11-21-13-22-17-6-4-5-16(20-17)19-15-9-7-14(18)8-10-15/h4-10H,11-13H2,1-3H3,(H,19,20)
InChIKeyVCENJMNQTQOSKV-UHFFFAOYSA-N
MW350.92 g/mol
LogP5.17
Rot. Bonds8

About N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine

N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine (PubChem CID 141340384) has the molecular formula C17H23ClN2O2Si and a molecular weight of 350.92 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine
PubChem CID141340384
Molecular FormulaC17H23ClN2O2Si
Molecular Weight350.92 g/mol
Exact Mass350.12
IUPAC NameN-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine
SMILESC[Si](C)(C)CCOCOc1cccc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C17H23ClN2O2Si/c1-23(2,3)12-11-21-13-22-17-6-4-5-16(20-17)19-15-9-7-14(18)8-10-15/h4-10H,11-13H2,1-3H3,(H,19,20)
InChIKeyVCENJMNQTQOSKV-UHFFFAOYSA-N
XLogP5.17
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.92
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine?
The IUPAC name of N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine (CID 141340384) is N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine.
What is the SMILES notation for N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine?
The canonical SMILES for N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine is C[Si](C)(C)CCOCOc1cccc(Nc2ccc(Cl)cc2)n1.
What is the InChIKey of N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine?
The InChIKey is VCENJMNQTQOSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2O2Si/c1-23(2,3)12-11-21-13-22-17-6-4-5-16(20-17)19-15-9-7-14(18)8-10-15/h4-10H,11-13H2,1-3H3,(H,19,20).
What are the key properties of N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine?
N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine has a molecular weight of 350.92 g/mol, XLogP of 5.17, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-6-(2-trimethylsilylethoxymethoxy)pyridin-2-amine is sourced from PubChem (CID 141340384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).