2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate

C11H21NO3 — CID 142740059

IUPAC2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate
SMILESCOCCOC(=O)N1C(C)CCCC1C
InChIInChI=1S/C11H21NO3/c1-9-5-4-6-10(2)12(9)11(13)15-8-7-14-3/h9-10H,4-8H2,1-3H3
InChIKeyWEAMNROVCOIRJY-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.03
Rot. Bonds3

About 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate

2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate (PubChem CID 142740059) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate.

Molecular Properties

Compound Name2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate
PubChem CID142740059
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate
SMILESCOCCOC(=O)N1C(C)CCCC1C
InChIInChI=1S/C11H21NO3/c1-9-5-4-6-10(2)12(9)11(13)15-8-7-14-3/h9-10H,4-8H2,1-3H3
InChIKeyWEAMNROVCOIRJY-UHFFFAOYSA-N
XLogP2.03
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-1-(2,6-dimethylpiperidin-1-yl)-5-methoxypentan-1-one
CID 81081732
benzyl 2,6-dimethylpiperidine-1-carboxylate
CID 69041433
tert-butyl (6R)-2,6-dimethylpiperidine-1-carboxylate
CID 144878026
N-(methoxymethyl)-2,6-dimethylpiperidine-1-carboxamide
CID 110675943
3-methylbutan-2-yl (2S,6R)-2,6-dimethylpiperidine-1-carboxylate;propane
CID 161221697
methyl (2S,6S)-2-methyl-6-(2-oxopropyl)piperidine-1-carboxylate
CID 134856290
1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-one
CID 103715004
N-(2,6-dimethylpiperidin-1-yl)-2-methoxyacetamide
CID 70906561
(4,5-dimethoxy-2-nitrocyclohexyl)methyl 2,6-dimethylpiperidine-1-carboxylate
CID 140530378
(2-amino-3,4,5-trimethoxyphenyl)methyl 2,6-dimethylpiperidine-1-carboxylate
CID 89234746
2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methoxybutanamide
CID 83021863
ethyl 4-(2,6-dimethylpiperidin-1-yl)-4-oxobutanoate
CID 63282257

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate?
The IUPAC name of 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate (CID 142740059) is 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate.
What is the SMILES notation for 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate?
The canonical SMILES for 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate is COCCOC(=O)N1C(C)CCCC1C.
What is the InChIKey of 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate?
The InChIKey is WEAMNROVCOIRJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9-5-4-6-10(2)12(9)11(13)15-8-7-14-3/h9-10H,4-8H2,1-3H3.
What are the key properties of 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate?
2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate has a molecular weight of 215.29 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl 2,6-dimethylpiperidine-1-carboxylate is sourced from PubChem (CID 142740059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).