methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate

C11H22N2O2 — CID 83990662

IUPACmethyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate
SMILESCCNC1CC(C)CN(CC(=O)OC)C1
InChIInChI=1S/C11H22N2O2/c1-4-12-10-5-9(2)6-13(7-10)8-11(14)15-3/h9-10,12H,4-8H2,1-3H3
InChIKeyQMUXGHXEQRUFLM-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.48
Rot. Bonds4

About methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate

methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate (PubChem CID 83990662) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate
PubChem CID83990662
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Namemethyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate
SMILESCCNC1CC(C)CN(CC(=O)OC)C1
InChIInChI=1S/C11H22N2O2/c1-4-12-10-5-9(2)6-13(7-10)8-11(14)15-3/h9-10,12H,4-8H2,1-3H3
InChIKeyQMUXGHXEQRUFLM-UHFFFAOYSA-N
XLogP0.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Methyl 2-[methyl(piperidin-4-yl)amino]acetate dihydrochloride
CID 22378095
Methyl 2-(3-aminopiperidin-1-yl)acetate dihydrochloride
CID 75527804
Methyl 2-(3-cyclopropylpiperazin-1-yl)acetate
CID 177798120
methyl 2-[(3S)-3-(2,2,2-trifluoroethylamino)piperidin-1-yl]acetate
CID 164633061
Methyl 2-(4-aminopiperidin-1-yl)acetate
CID 11435206
(3-Amino-piperidin-1-yl)-acetic acid methyl ester
CID 61295580
Methyl 2-[2,6-dimethyl-4-[5-(2,2,2-trifluoroethylamino)pentyl]piperazin-1-yl]acetate
CID 173504414
Methyl 2-(cyclopropylamino)-2-methyl-3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 65530055
Methyl 2-(ethylamino)-3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 65530244
Ethyl 2-(ethylamino)-3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 65530441
Ethyl 2-(propylamino)-3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 65530633
Ethyl 2-(propan-2-ylamino)-3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 65530634

Frequently Asked Questions

What is the IUPAC name of methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate?
The IUPAC name of methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate (CID 83990662) is methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate.
What is the SMILES notation for methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate?
The canonical SMILES for methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate is CCNC1CC(C)CN(CC(=O)OC)C1.
What is the InChIKey of methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate?
The InChIKey is QMUXGHXEQRUFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-12-10-5-9(2)6-13(7-10)8-11(14)15-3/h9-10,12H,4-8H2,1-3H3.
What are the key properties of methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate?
methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate has a molecular weight of 214.31 g/mol, XLogP of 0.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[3-(ethylamino)-5-methylpiperidin-1-yl]acetate is sourced from PubChem (CID 83990662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).