tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate

C15H30N2O3 — CID 83206653

IUPACtert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate
SMILESCN(C)CCOC1(C)CCN(C(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O3/c1-14(2,3)20-13(18)17-9-7-15(4,8-10-17)19-12-11-16(5)6/h7-12H2,1-6H3
InChIKeySIVOHDGIOBHMBZ-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.35
Rot. Bonds4

About tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate

tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate (PubChem CID 83206653) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate
PubChem CID83206653
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Nametert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate
SMILESCN(C)CCOC1(C)CCN(C(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O3/c1-14(2,3)20-13(18)17-9-7-15(4,8-10-17)19-12-11-16(5)6/h7-12H2,1-6H3
InChIKeySIVOHDGIOBHMBZ-UHFFFAOYSA-N
XLogP2.35
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl 4-methyl-4-(4-methylpentoxy)piperidine-1-carboxylate
CID 83206494
tert-butyl 4-methyl-4-(2,2,2-trifluoroethoxy)piperidine-1-carboxylate
CID 83207570
tert-butyl 4-(2,2-dimethoxyethoxy)-4-methylpiperidine-1-carboxylate
CID 83206348
tert-butyl 4-(cyclopentylmethoxy)-4-methylpiperidine-1-carboxylate
CID 83207659
tert-butyl 4-methyl-4-[2-oxo-2-(propan-2-ylamino)ethoxy]piperidine-1-carboxylate
CID 103915982
tert-butyl 3-decoxy-3-methylpyrrolidine-1-carboxylate
CID 113351248
tert-butyl 3-(3-hydroxybutoxy)-3-methylpyrrolidine-1-carboxylate
CID 106938832
tert-butyl 4-(3-imidazol-1-ylpropoxy)-4-methylpiperidine-1-carboxylate
CID 103916001
tert-butyl 4,4-bis(aminomethyl)piperidine-1-carboxylate
CID 126502774
tert-butyl 4-[3-(dimethylamino)-3-oxopropoxy]-4-ethylpiperidine-1-carboxylate
CID 103916049
tert-butyl 4-methyl-4-[(4-methylphenyl)methoxy]piperidine-1-carboxylate
CID 103915896
tert-butyl 7-azaspiro[3.5]nonane-7-carboxylate
CID 130609664

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate (CID 83206653) is tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate is CN(C)CCOC1(C)CCN(C(=O)OC(C)(C)C)CC1.
What is the InChIKey of tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate?
The InChIKey is SIVOHDGIOBHMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-14(2,3)20-13(18)17-9-7-15(4,8-10-17)19-12-11-16(5)6/h7-12H2,1-6H3.
What are the key properties of tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate?
tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate has a molecular weight of 286.42 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[2-(dimethylamino)ethoxy]-4-methylpiperidine-1-carboxylate is sourced from PubChem (CID 83206653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).