[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine

C16H32N2O2 — CID 107391225

IUPAC[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
SMILESCOC1(C)CCCN(C2(CN)CC(C)(C)OC2(C)C)C1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-16(11-17,14(3,4)20-13)18-9-7-8-15(5,12-18)19-6/h7-12,17H2,1-6H3
InChIKeyHOFFAMAEVAHBBZ-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.16
Rot. Bonds3

About [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine

[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine (PubChem CID 107391225) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine.

Molecular Properties

Compound Name[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
PubChem CID107391225
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
SMILESCOC1(C)CCCN(C2(CN)CC(C)(C)OC2(C)C)C1
InChIInChI=1S/C16H32N2O2/c1-13(2)10-16(11-17,14(3,4)20-13)18-9-7-8-15(5,12-18)19-6/h7-12,17H2,1-6H3
InChIKeyHOFFAMAEVAHBBZ-UHFFFAOYSA-N
XLogP2.16
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3-methoxy-3-methylpiperidin-1-yl)cyclobutyl]methanamine
CID 107391366
[1-(3-methoxy-3-methylpiperidin-1-yl)-3,3-dimethylcyclohexyl]methanamine
CID 107391476
[3-(3,4-dimethylpyrrolidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79927192
[3-(4-tert-butylpiperazin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79911679
[3-(2,6-dimethylmorpholin-4-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79928510
[1-(3-methoxy-3-methylpiperidin-1-yl)-2-methylcyclohexyl]methanamine
CID 107391361
[2-ethyl-1-(3-methoxy-3-methylpiperidin-1-yl)cyclopentyl]methanamine
CID 107391328
[3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79937688
[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine
CID 79916036
[2-(3-methoxy-3-methylpiperidin-1-yl)-2-bicyclo[2.2.1]heptanyl]methanamine
CID 107391109
1-[3-(aminomethyl)-2,2,5,5-tetramethyloxolan-3-yl]-N,N-diethylpyrrolidin-3-amine
CID 79911235
[1-(3-methoxy-3-methylazetidin-1-yl)cyclobutyl]methanamine
CID 130964277

Frequently Asked Questions

What is the IUPAC name of [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine?
The IUPAC name of [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine (CID 107391225) is [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine.
What is the SMILES notation for [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine?
The canonical SMILES for [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine is COC1(C)CCCN(C2(CN)CC(C)(C)OC2(C)C)C1.
What is the InChIKey of [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine?
The InChIKey is HOFFAMAEVAHBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-13(2)10-16(11-17,14(3,4)20-13)18-9-7-8-15(5,12-18)19-6/h7-12,17H2,1-6H3.
What are the key properties of [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine?
[3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine has a molecular weight of 284.44 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methoxy-3-methylpiperidin-1-yl)-2,2,5,5-tetramethyloxolan-3-yl]methanamine is sourced from PubChem (CID 107391225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).