methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate

C10H12N2O4 — CID 70798080

IUPACmethyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate
SMILESCOC(=O)CNC(=O)c1ccc(OC)cn1
InChIInChI=1S/C10H12N2O4/c1-15-7-3-4-8(11-5-7)10(14)12-6-9(13)16-2/h3-5H,6H2,1-2H3,(H,12,14)
InChIKeyKLUAVGWCQQJXQV-UHFFFAOYSA-N
MW224.22 g/mol
LogP-0.01
Rot. Bonds4

About methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate

methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate (PubChem CID 70798080) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate
PubChem CID70798080
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Namemethyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate
SMILESCOC(=O)CNC(=O)c1ccc(OC)cn1
InChIInChI=1S/C10H12N2O4/c1-15-7-3-4-8(11-5-7)10(14)12-6-9(13)16-2/h3-5H,6H2,1-2H3,(H,12,14)
InChIKeyKLUAVGWCQQJXQV-UHFFFAOYSA-N
XLogP-0.01
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate (CID 70798080) is methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate is COC(=O)CNC(=O)c1ccc(OC)cn1.
What is the InChIKey of methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate?
The InChIKey is KLUAVGWCQQJXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-15-7-3-4-8(11-5-7)10(14)12-6-9(13)16-2/h3-5H,6H2,1-2H3,(H,12,14).
What are the key properties of methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate?
methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate has a molecular weight of 224.22 g/mol, XLogP of -0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate is sourced from PubChem (CID 70798080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).