(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate

C11H22N2O2 — CID 19753089

IUPAC(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate
SMILESCN(C)CC(=O)OCC1CCCCN1C
InChIInChI=1S/C11H22N2O2/c1-12(2)8-11(14)15-9-10-6-4-5-7-13(10)3/h10H,4-9H2,1-3H3
InChIKeySEBDLPAAWOVKQY-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.58
Rot. Bonds4

About (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate

(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate (PubChem CID 19753089) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate.

Molecular Properties

Compound Name(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate
PubChem CID19753089
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate
SMILESCN(C)CC(=O)OCC1CCCCN1C
InChIInChI=1S/C11H22N2O2/c1-12(2)8-11(14)15-9-10-6-4-5-7-13(10)3/h10H,4-9H2,1-3H3
InChIKeySEBDLPAAWOVKQY-UHFFFAOYSA-N
XLogP0.58
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate?
The IUPAC name of (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate (CID 19753089) is (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate.
What is the SMILES notation for (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate?
The canonical SMILES for (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate is CN(C)CC(=O)OCC1CCCCN1C.
What is the InChIKey of (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate?
The InChIKey is SEBDLPAAWOVKQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-12(2)8-11(14)15-9-10-6-4-5-7-13(10)3/h10H,4-9H2,1-3H3.
What are the key properties of (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate?
(1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate has a molecular weight of 214.31 g/mol, XLogP of 0.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpiperidin-2-yl)methyl 2-(dimethylamino)acetate is sourced from PubChem (CID 19753089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).