methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate

C10H12N2O3 — CID 43407333

IUPACmethyl 2-[methyl(pyridine-2-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1ccccn1
InChIInChI=1S/C10H12N2O3/c1-12(7-9(13)15-2)10(14)8-5-3-4-6-11-8/h3-6H,7H2,1-2H3
InChIKeyIGHSMPGJZKNZSB-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.33
Rot. Bonds3

About methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate

methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate (PubChem CID 43407333) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl(pyridine-2-carbonyl)amino]acetate
PubChem CID43407333
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Namemethyl 2-[methyl(pyridine-2-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1ccccn1
InChIInChI=1S/C10H12N2O3/c1-12(7-9(13)15-2)10(14)8-5-3-4-6-11-8/h3-6H,7H2,1-2H3
InChIKeyIGHSMPGJZKNZSB-UHFFFAOYSA-N
XLogP0.33
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate (CID 43407333) is methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate is COC(=O)CN(C)C(=O)c1ccccn1.
What is the InChIKey of methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate?
The InChIKey is IGHSMPGJZKNZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-12(7-9(13)15-2)10(14)8-5-3-4-6-11-8/h3-6H,7H2,1-2H3.
What are the key properties of methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate?
methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate has a molecular weight of 208.22 g/mol, XLogP of 0.33, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate is sourced from PubChem (CID 43407333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).