ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate

C10H19NO3 — CID 61021514

IUPACethyl 2-[ethyl(2-methylpropanoyl)amino]acetate
SMILESCCOC(=O)CN(CC)C(=O)C(C)C
InChIInChI=1S/C10H19NO3/c1-5-11(10(13)8(3)4)7-9(12)14-6-2/h8H,5-7H2,1-4H3
InChIKeyWXRJZOOFYPJREP-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.05
Rot. Bonds5

About ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate

ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate (PubChem CID 61021514) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[ethyl(2-methylpropanoyl)amino]acetate
PubChem CID61021514
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nameethyl 2-[ethyl(2-methylpropanoyl)amino]acetate
SMILESCCOC(=O)CN(CC)C(=O)C(C)C
InChIInChI=1S/C10H19NO3/c1-5-11(10(13)8(3)4)7-9(12)14-6-2/h8H,5-7H2,1-4H3
InChIKeyWXRJZOOFYPJREP-UHFFFAOYSA-N
XLogP1.05
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 107905016
ethyl 2-[2-acetamidopropanoyl(ethyl)amino]acetate
CID 54900981
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CID 61012376
ethyl 2-[carbonochloridoyl(ethyl)amino]acetate
CID 168874340
N-ethyl-2-methyl-N-(2-methylprop-2-enyl)propanamide
CID 60660134
ethyl 2-[2-(4-bromophenoxy)propanoyl-ethylamino]acetate
CID 61012258
2-[carboxymethyl-[(2-ethoxy-2-oxoethyl)-ethylcarbamoyl]amino]acetic acid
CID 63644812
5-[[(2-ethoxy-2-oxoethyl)-ethylcarbamoyl]amino]-3-methyl-5-oxopentanoic acid
CID 62965168
(2R)-2-[[(2-ethoxy-2-oxoethyl)-ethylcarbamoyl]amino]-3-methylbutanoic acid
CID 79009643
ethyl 2-[[(2R)-2-amino-3-methylbutanoyl]-(2-methylpropyl)amino]acetate
CID 79013313
4-[(2-ethoxy-2-oxoethyl)-propylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498133
ethyl 2-[tert-butylcarbamoyl(ethyl)amino]acetate
CID 61012269

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate?
The IUPAC name of ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate (CID 61021514) is ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate.
What is the SMILES notation for ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate?
The canonical SMILES for ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate is CCOC(=O)CN(CC)C(=O)C(C)C.
What is the InChIKey of ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate?
The InChIKey is WXRJZOOFYPJREP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-5-11(10(13)8(3)4)7-9(12)14-6-2/h8H,5-7H2,1-4H3.
What are the key properties of ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate?
ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate has a molecular weight of 201.27 g/mol, XLogP of 1.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[ethyl(2-methylpropanoyl)amino]acetate is sourced from PubChem (CID 61021514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).