6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one

C14H25NO2Si — CID 134971089

IUPAC6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one
SMILESCC(C)(C)[Si](C)(C)OCCCc1cccc(=O)[nH]1
InChIInChI=1S/C14H25NO2Si/c1-14(2,3)18(4,5)17-11-7-9-12-8-6-10-13(16)15-12/h6,8,10H,7,9,11H2,1-5H3,(H,15,16)
InChIKeyJZMGOUKQRAIZCE-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.33
Rot. Bonds5

About 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one

6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one (PubChem CID 134971089) has the molecular formula C14H25NO2Si and a molecular weight of 267.44 g/mol. Its IUPAC name is 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one
PubChem CID134971089
Molecular FormulaC14H25NO2Si
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one
SMILESCC(C)(C)[Si](C)(C)OCCCc1cccc(=O)[nH]1
InChIInChI=1S/C14H25NO2Si/c1-14(2,3)18(4,5)17-11-7-9-12-8-6-10-13(16)15-12/h6,8,10H,7,9,11H2,1-5H3,(H,15,16)
InChIKeyJZMGOUKQRAIZCE-UHFFFAOYSA-N
XLogP3.33
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one?
The IUPAC name of 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one (CID 134971089) is 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one is CC(C)(C)[Si](C)(C)OCCCc1cccc(=O)[nH]1.
What is the InChIKey of 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one?
The InChIKey is JZMGOUKQRAIZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2Si/c1-14(2,3)18(4,5)17-11-7-9-12-8-6-10-13(16)15-12/h6,8,10H,7,9,11H2,1-5H3,(H,15,16).
What are the key properties of 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one?
6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one has a molecular weight of 267.44 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyridin-2-one is sourced from PubChem (CID 134971089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).