methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate

C10H14N2O3 — CID 1384057

IUPACmethyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate
SMILESCOC(=O)Cn1c(C)cc(C)c(N)c1=O
InChIInChI=1S/C10H14N2O3/c1-6-4-7(2)12(5-8(13)15-3)10(14)9(6)11/h4H,5,11H2,1-3H3
InChIKeyGBMRUYOYMABZPX-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.22
Rot. Bonds2

About methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate

methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate (PubChem CID 1384057) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate.

Molecular Properties

Compound Namemethyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate
PubChem CID1384057
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Namemethyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate
SMILESCOC(=O)Cn1c(C)cc(C)c(N)c1=O
InChIInChI=1S/C10H14N2O3/c1-6-4-7(2)12(5-8(13)15-3)10(14)9(6)11/h4H,5,11H2,1-3H3
InChIKeyGBMRUYOYMABZPX-UHFFFAOYSA-N
XLogP0.22
TPSA74.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate?
The IUPAC name of methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate (CID 1384057) is methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate.
What is the SMILES notation for methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate?
The canonical SMILES for methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate is COC(=O)Cn1c(C)cc(C)c(N)c1=O.
What is the InChIKey of methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate?
The InChIKey is GBMRUYOYMABZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-4-7(2)12(5-8(13)15-3)10(14)9(6)11/h4H,5,11H2,1-3H3.
What are the key properties of methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate?
methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate has a molecular weight of 210.23 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)acetate is sourced from PubChem (CID 1384057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).