phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate

C19H26N2O3Si — CID 86676146

IUPACphenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate
SMILESCC(C)(C)[Si](C)(C)OCc1cnccc1NC(=O)Oc1ccccc1
InChIInChI=1S/C19H26N2O3Si/c1-19(2,3)25(4,5)23-14-15-13-20-12-11-17(15)21-18(22)24-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3,(H,20,21,22)
InChIKeyIPCOLHXZGHGGNL-UHFFFAOYSA-N
MW358.51 g/mol
LogP5.21
Rot. Bonds5

About phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate

phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate (PubChem CID 86676146) has the molecular formula C19H26N2O3Si and a molecular weight of 358.51 g/mol. Its IUPAC name is phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate.

Molecular Properties

Compound Namephenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate
PubChem CID86676146
Molecular FormulaC19H26N2O3Si
Molecular Weight358.51 g/mol
Exact Mass358.17
IUPAC Namephenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate
SMILESCC(C)(C)[Si](C)(C)OCc1cnccc1NC(=O)Oc1ccccc1
InChIInChI=1S/C19H26N2O3Si/c1-19(2,3)25(4,5)23-14-15-13-20-12-11-17(15)21-18(22)24-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3,(H,20,21,22)
InChIKeyIPCOLHXZGHGGNL-UHFFFAOYSA-N
XLogP5.21
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.51
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate?
The IUPAC name of phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate (CID 86676146) is phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate.
What is the SMILES notation for phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate?
The canonical SMILES for phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate is CC(C)(C)[Si](C)(C)OCc1cnccc1NC(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate?
The InChIKey is IPCOLHXZGHGGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3Si/c1-19(2,3)25(4,5)23-14-15-13-20-12-11-17(15)21-18(22)24-16-9-7-6-8-10-16/h6-13H,14H2,1-5H3,(H,20,21,22).
What are the key properties of phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate?
phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate has a molecular weight of 358.51 g/mol, XLogP of 5.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-pyridinyl]carbamate is sourced from PubChem (CID 86676146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).