ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate

C11H16N2O2 — CID 60788232

IUPACethyl 2-(methylamino)-2-pyridin-2-ylpropanoate
SMILESCCOC(=O)C(C)(NC)c1ccccn1
InChIInChI=1S/C11H16N2O2/c1-4-15-10(14)11(2,12-3)9-7-5-6-8-13-9/h5-8,12H,4H2,1-3H3
InChIKeyJOLNWHGSFAGLSR-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.08
Rot. Bonds4

About ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate

ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate (PubChem CID 60788232) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate.

Molecular Properties

Compound Nameethyl 2-(methylamino)-2-pyridin-2-ylpropanoate
PubChem CID60788232
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Nameethyl 2-(methylamino)-2-pyridin-2-ylpropanoate
SMILESCCOC(=O)C(C)(NC)c1ccccn1
InChIInChI=1S/C11H16N2O2/c1-4-15-10(14)11(2,12-3)9-7-5-6-8-13-9/h5-8,12H,4H2,1-3H3
InChIKeyJOLNWHGSFAGLSR-UHFFFAOYSA-N
XLogP1.08
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2R)-2-(methylamino)-2-pyridin-2-ylpropanoate
CID 93309846
triethyl pyridin-2-ylmethanetricarboxylate
CID 102130107
ethyl 2-(methylamino)-2,3-dipyridin-2-ylpropanoate
CID 174613279
ethyl 2-(2-azidoethylamino)-2-pyridin-2-ylpropanoate
CID 66189843
ethyl 2-(5-fluoro-2-pyridinyl)-2-(methylamino)propanoate
CID 83119923
ethyl 2-(2-chlorophenyl)-2-(methylamino)propanoate
CID 60788388
ethyl 3,3-difluoro-3-pyridin-2-ylpropanoate
CID 83853858
ethyl 2-(4-methylpiperazin-1-yl)-2-pyridin-2-ylpropanoate
CID 59570548
ethyl (3S)-3-hydroxy-3-phenyl-3-pyridin-2-ylpropanoate
CID 124644619
methyl 2-methyl-2-pyridin-2-ylpropanoate
CID 58077167
2-pyridin-2-ylpropan-2-yl carbamate
CID 67418657
3-methyl-3-pyridin-2-ylbutanamide
CID 67998308

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate?
The IUPAC name of ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate (CID 60788232) is ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate.
What is the SMILES notation for ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate?
The canonical SMILES for ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate is CCOC(=O)C(C)(NC)c1ccccn1.
What is the InChIKey of ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate?
The InChIKey is JOLNWHGSFAGLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-4-15-10(14)11(2,12-3)9-7-5-6-8-13-9/h5-8,12H,4H2,1-3H3.
What are the key properties of ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate?
ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate has a molecular weight of 208.26 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(methylamino)-2-pyridin-2-ylpropanoate is sourced from PubChem (CID 60788232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).