methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate

C15H31NO3Si — CID 66732037

IUPACmethyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate
SMILESCOC(=O)N1CCC(CO[Si](C)(C)C(C)(C)C)CC1C
InChIInChI=1S/C15H31NO3Si/c1-12-10-13(8-9-16(12)14(17)18-5)11-19-20(6,7)15(2,3)4/h12-13H,8-11H2,1-7H3
InChIKeyDCPYQILSMQCRRK-UHFFFAOYSA-N
MW301.50 g/mol
LogP3.88
Rot. Bonds3

About methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate

methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate (PubChem CID 66732037) has the molecular formula C15H31NO3Si and a molecular weight of 301.50 g/mol. Its IUPAC name is methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate.

Molecular Properties

Compound Namemethyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate
PubChem CID66732037
Molecular FormulaC15H31NO3Si
Molecular Weight301.50 g/mol
Exact Mass301.21
IUPAC Namemethyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate
SMILESCOC(=O)N1CCC(CO[Si](C)(C)C(C)(C)C)CC1C
InChIInChI=1S/C15H31NO3Si/c1-12-10-13(8-9-16(12)14(17)18-5)11-19-20(6,7)15(2,3)4/h12-13H,8-11H2,1-7H3
InChIKeyDCPYQILSMQCRRK-UHFFFAOYSA-N
XLogP3.88
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.50
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl (2R,4R)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(hydroxymethyl)piperidine-1-carboxylate
CID 150868711
3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidine-1-carboxylic acid
CID 90457958
methyl 2,4-dimethylpiperidine-1-carboxylate
CID 115643665
methyl (2S,4R)-2,4-dimethylpiperidine-1-carboxylate
CID 145048176
ethane;methyl 4-methoxy-2-methylpiperidine-1-carboxylate
CID 164564582
methyl (2S,4R)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidine-2-carboxylate
CID 68931973
methyl 2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-2-(3,5-dichlorophenyl)propanoate
CID 123534109
tert-butyl (2S,4S)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CID 66733511
tert-butyl N-[6-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-1-yl]-2-fluoro-3-pyridinyl]carbamate
CID 46318074
tert-butyl 4-[(4-methoxypiperidin-1-yl)methyl]-2-methylpiperidine-1-carboxylate
CID 126842158
methyl 2-(2,2-dimethylpropyl)-4-(hydroxymethyl)piperidine-1-carboxylate
CID 66731661
methyl 3-methylmorpholine-4-carboxylate
CID 110292243

Frequently Asked Questions

What is the IUPAC name of methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate?
The IUPAC name of methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate (CID 66732037) is methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate.
What is the SMILES notation for methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate?
The canonical SMILES for methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate is COC(=O)N1CCC(CO[Si](C)(C)C(C)(C)C)CC1C.
What is the InChIKey of methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate?
The InChIKey is DCPYQILSMQCRRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO3Si/c1-12-10-13(8-9-16(12)14(17)18-5)11-19-20(6,7)15(2,3)4/h12-13H,8-11H2,1-7H3.
What are the key properties of methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate?
methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate has a molecular weight of 301.50 g/mol, XLogP of 3.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylpiperidine-1-carboxylate is sourced from PubChem (CID 66732037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).