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

C12H16N2O3 — CID 54979638

IUPACmethyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate
SMILESCCN(CC(=O)OC)C(=O)c1ccc(C)nc1
InChIInChI=1S/C12H16N2O3/c1-4-14(8-11(15)17-3)12(16)10-6-5-9(2)13-7-10/h5-7H,4,8H2,1-3H3
InChIKeyVIWMGBKXMJLYPM-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.03
Rot. Bonds4

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

methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate (PubChem CID 54979638) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate
PubChem CID54979638
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Namemethyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate
SMILESCCN(CC(=O)OC)C(=O)c1ccc(C)nc1
InChIInChI=1S/C12H16N2O3/c1-4-14(8-11(15)17-3)12(16)10-6-5-9(2)13-7-10/h5-7H,4,8H2,1-3H3
InChIKeyVIWMGBKXMJLYPM-UHFFFAOYSA-N
XLogP1.03
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.03
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-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 43409840
N-(2-chloroethyl)-N-ethyl-6-methylpyridine-3-carboxamide
CID 63395365
N-(2-amino-2-hydroxyiminoethyl)-N-ethyl-6-methylpyridine-3-carboxamide
CID 76929152
N-[2-(azepan-1-yl)-2-oxoethyl]-N-ethyl-6-methylpyridine-3-carboxamide
CID 138999191
methyl 2-[cyclopentyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 80709959
methyl 2-[(6-fluoropyridine-3-carbonyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 63979190
methyl 2-[benzoyl(ethyl)amino]acetate
CID 57002755
methyl 2-[ethyl-(4-methylsulfanylbenzoyl)amino]acetate
CID 54979363
3-[ethyl-(6-methylpyridine-3-carbonyl)amino]-2-methylpropanoic acid
CID 62826642
methyl 2-[(1,3-dimethylpyrazolo[5,4-b]pyridine-5-carbonyl)-ethylamino]acetate
CID 61409505
methyl 2-[ethyl-[4-(methylsulfonylmethyl)benzoyl]amino]acetate
CID 61383449

Frequently Asked Questions

What is the IUPAC name of methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate (CID 54979638) is methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate is CCN(CC(=O)OC)C(=O)c1ccc(C)nc1.
What is the InChIKey of methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate?
The InChIKey is VIWMGBKXMJLYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-4-14(8-11(15)17-3)12(16)10-6-5-9(2)13-7-10/h5-7H,4,8H2,1-3H3.
What are the key properties of methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate?
methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate has a molecular weight of 236.27 g/mol, XLogP of 1.03, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[ethyl-(6-methylpyridine-3-carbonyl)amino]acetate is sourced from PubChem (CID 54979638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).