2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine

C14H28N2O2 — CID 107391237

IUPAC2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
SMILESCOC1(C)CCCN(C(CN)C2CCC(C)O2)C1
InChIInChI=1S/C14H28N2O2/c1-11-5-6-13(18-11)12(9-15)16-8-4-7-14(2,10-16)17-3/h11-13H,4-10,15H2,1-3H3
InChIKeyNMDFJAGNNCYDGR-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.38
Rot. Bonds4

About 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine

2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine (PubChem CID 107391237) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
PubChem CID107391237
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
SMILESCOC1(C)CCCN(C(CN)C2CCC(C)O2)C1
InChIInChI=1S/C14H28N2O2/c1-11-5-6-13(18-11)12(9-15)16-8-4-7-14(2,10-16)17-3/h11-13H,4-10,15H2,1-3H3
InChIKeyNMDFJAGNNCYDGR-UHFFFAOYSA-N
XLogP1.38
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cycloheptyl-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107391216
2-(5-methyloxolan-2-yl)-2-(4-propan-2-ylazepan-1-yl)ethanamine
CID 82835219
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(5-methyloxolan-2-yl)ethanamine
CID 82837635
2-(3-methoxy-4-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
CID 102965010
2-(5-methyloxolan-2-yl)-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanamine
CID 82839609
2-(5-methyloxolan-2-yl)-2-(2-propan-2-ylpyrrolidin-1-yl)ethanamine
CID 82835625
2-(4-ethyl-3-methylpiperazin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
CID 82835718
N'-hydroxy-2-(3-methoxy-3-methylpiperidin-1-yl)butanimidamide
CID 107392874
2-(3-methoxy-3-methylpiperidin-1-yl)-2-[5-(2-methylcyclopropyl)furan-2-yl]ethanamine
CID 107391309
2-(3,5-dimethylphenyl)-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107391351
3-amino-2-(3-methoxy-3-methylpiperidin-1-yl)pentan-1-ol
CID 107391776
2-(5-chlorothiophen-2-yl)-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107390745

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine?
The IUPAC name of 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine (CID 107391237) is 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine?
The canonical SMILES for 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine is COC1(C)CCCN(C(CN)C2CCC(C)O2)C1.
What is the InChIKey of 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine?
The InChIKey is NMDFJAGNNCYDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11-5-6-13(18-11)12(9-15)16-8-4-7-14(2,10-16)17-3/h11-13H,4-10,15H2,1-3H3.
What are the key properties of 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine?
2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine has a molecular weight of 256.39 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine is sourced from PubChem (CID 107391237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).