2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide

C12H16N2O4 — CID 60666680

IUPAC2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide
SMILESCOc1cc(C)ccc1OCC(=O)NCC(N)=O
InChIInChI=1S/C12H16N2O4/c1-8-3-4-9(10(5-8)17-2)18-7-12(16)14-6-11(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyIYFJIOZSAQVNHJ-UHFFFAOYSA-N
MW252.27 g/mol
LogP-0.02
Rot. Bonds6

About 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide

2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide (PubChem CID 60666680) has the molecular formula C12H16N2O4 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound Name2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide
PubChem CID60666680
Molecular FormulaC12H16N2O4
Molecular Weight252.27 g/mol
Exact Mass252.11
IUPAC Name2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide
SMILESCOc1cc(C)ccc1OCC(=O)NCC(N)=O
InChIInChI=1S/C12H16N2O4/c1-8-3-4-9(10(5-8)17-2)18-7-12(16)14-6-11(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyIYFJIOZSAQVNHJ-UHFFFAOYSA-N
XLogP-0.02
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide
CID 18163671
2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide
CID 9296003
2-(2-methoxy-4-methylphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 2627667
2-(2-methoxy-4-methylphenoxy)-N-[(E)-pent-3-enyl]acetamide
CID 115628343
N-[(4-fluorophenyl)methyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 7919164
2-(2-methoxy-4-methylphenoxy)-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
CID 115699567
4-[2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]ethyl]benzoic acid
CID 45347313
2-(2-methoxy-4-methylphenoxy)-N-[(3-methyloxetan-3-yl)methyl]acetamide
CID 78956644
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 31449562
N-(3-hydroxy-4-methoxybutyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 103876701
4-[[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]methyl]-N,N-dimethylbenzamide
CID 134039174
N-[(4-fluoro-3-methylphenyl)methyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18129838

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide?
The IUPAC name of 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide (CID 60666680) is 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide?
The canonical SMILES for 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide is COc1cc(C)ccc1OCC(=O)NCC(N)=O.
What is the InChIKey of 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide?
The InChIKey is IYFJIOZSAQVNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O4/c1-8-3-4-9(10(5-8)17-2)18-7-12(16)14-6-11(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16).
What are the key properties of 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide?
2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide has a molecular weight of 252.27 g/mol, XLogP of -0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 60666680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).