2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid

C9H17NO4 — CID 62823516

IUPAC2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid
SMILESCCN(C(=O)COC)C(C)(C)C(=O)O
InChIInChI=1S/C9H17NO4/c1-5-10(7(11)6-14-4)9(2,3)8(12)13/h5-6H2,1-4H3,(H,12,13)
InChIKeyWIBPSBSTFQFAQG-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.34
Rot. Bonds5

About 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid

2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid (PubChem CID 62823516) has the molecular formula C9H17NO4 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid.

Molecular Properties

Compound Name2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid
PubChem CID62823516
Molecular FormulaC9H17NO4
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Name2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid
SMILESCCN(C(=O)COC)C(C)(C)C(=O)O
InChIInChI=1S/C9H17NO4/c1-5-10(7(11)6-14-4)9(2,3)8(12)13/h5-6H2,1-4H3,(H,12,13)
InChIKeyWIBPSBSTFQFAQG-UHFFFAOYSA-N
XLogP0.34
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl-[2-(2-methoxyethoxy)acetyl]amino]-2-methylpropanoic acid
CID 62818599
2-[[2-(4-bromophenoxy)acetyl]-ethylamino]-2-methylpropanoic acid
CID 62819651
2-[ethyl(3-methylpentanoyl)amino]-2-methylpropanoic acid
CID 114873698
2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]-2-methylpropanoic acid
CID 62818406
2-[[2-(2,2-dimethylpropanoylamino)acetyl]-ethylamino]-2-methylpropanoic acid
CID 62818946
2-[ethyl(4-methoxybutylcarbamoyl)amino]-2-methylpropanoic acid
CID 55123707
2-[ethyl-[2-methoxyethyl(3-methoxypropyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62820097
2-[ethyl-[(1-methoxy-1-oxopropan-2-yl)carbamoyl]amino]-2-methylpropanoic acid
CID 55123852
2-[ethyl-[2-(thian-4-yl)acetyl]amino]-2-methylpropanoic acid
CID 83146101
2-[[2-(1-aminocyclobutyl)acetyl]-ethylamino]-2-methylpropanoic acid
CID 79854038
2-[(2-amino-2-methylbutanoyl)-ethylamino]-2-methylpropanoic acid
CID 79811560
2-[ethyl-[(1-methoxy-4-methyl-1-oxopentan-2-yl)carbamoyl]amino]-2-methylpropanoic acid
CID 62822221

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid?
The IUPAC name of 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid (CID 62823516) is 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid.
What is the SMILES notation for 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid?
The canonical SMILES for 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid is CCN(C(=O)COC)C(C)(C)C(=O)O.
What is the InChIKey of 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid?
The InChIKey is WIBPSBSTFQFAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO4/c1-5-10(7(11)6-14-4)9(2,3)8(12)13/h5-6H2,1-4H3,(H,12,13).
What are the key properties of 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid?
2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid has a molecular weight of 203.24 g/mol, XLogP of 0.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-methoxyacetyl)amino]-2-methylpropanoic acid is sourced from PubChem (CID 62823516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).