methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate

C11H14N2O3 — CID 43409840

IUPACmethyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1ccc(C)nc1
InChIInChI=1S/C11H14N2O3/c1-8-4-5-9(6-12-8)11(15)13(2)7-10(14)16-3/h4-6H,7H2,1-3H3
InChIKeyIPRFZFNLLQCHEJ-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.64
Rot. Bonds3

About methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate

methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate (PubChem CID 43409840) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
PubChem CID43409840
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Namemethyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)c1ccc(C)nc1
InChIInChI=1S/C11H14N2O3/c1-8-4-5-9(6-12-8)11(15)13(2)7-10(14)16-3/h4-6H,7H2,1-3H3
InChIKeyIPRFZFNLLQCHEJ-UHFFFAOYSA-N
XLogP0.64
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(2-methoxy-2-oxoethyl)-(6-methylpyridine-3-carbonyl)amino]acetate
CID 62952960
methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 54979638
methyl 2-[cyclopentyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 80709959
N-(2-hydroxy-3-methoxypropyl)-N,6-dimethylpyridine-3-carboxamide
CID 54993418
N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
CID 39975112
methyl 2-[(4-iodobenzoyl)-methylamino]acetate
CID 43407349
N-(5-hydroxypentyl)-N,6-dimethylpyridine-3-carboxamide
CID 107201918
N-methoxy-N,6-dimethylpyridine-3-carboxamide;1-(6-methyl-3-pyridinyl)ethanone
CID 159365691
N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide
CID 79652120
methyl 2-[[4-[(dimethylamino)methyl]benzoyl]-methylamino]acetate
CID 43409765
methyl 2-[(3-chloro-4-methylbenzoyl)-methylamino]acetate
CID 63194919
methyl 2-[methyl-(4-propoxybenzoyl)amino]acetate
CID 43407552

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate (CID 43409840) is methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate is COC(=O)CN(C)C(=O)c1ccc(C)nc1.
What is the InChIKey of methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The InChIKey is IPRFZFNLLQCHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-8-4-5-9(6-12-8)11(15)13(2)7-10(14)16-3/h4-6H,7H2,1-3H3.
What are the key properties of methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate?
methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate has a molecular weight of 222.24 g/mol, XLogP of 0.64, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate is sourced from PubChem (CID 43409840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).