2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid

C10H20N2O4 — CID 103224639

IUPAC2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid
SMILESCCNC(=O)CN(CC)C(COC)C(=O)O
InChIInChI=1S/C10H20N2O4/c1-4-11-9(13)6-12(5-2)8(7-16-3)10(14)15/h8H,4-7H2,1-3H3,(H,11,13)(H,14,15)
InChIKeyLKSTYALCZRMFMC-UHFFFAOYSA-N
MW232.28 g/mol
LogP-0.46
Rot. Bonds8

About 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid

2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid (PubChem CID 103224639) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid.

Molecular Properties

Compound Name2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid
PubChem CID103224639
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Name2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid
SMILESCCNC(=O)CN(CC)C(COC)C(=O)O
InChIInChI=1S/C10H20N2O4/c1-4-11-9(13)6-12(5-2)8(7-16-3)10(14)15/h8H,4-7H2,1-3H3,(H,11,13)(H,14,15)
InChIKeyLKSTYALCZRMFMC-UHFFFAOYSA-N
XLogP-0.46
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-2-[ethyl-(1-hydrazinyl-1-oxopentan-2-yl)amino]acetamide
CID 83047175
N-ethyl-2-[ethyl-(4-hydrazinyl-4-oxobutan-2-yl)amino]acetamide
CID 63577879
N-ethyl-2-[ethyl-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)amino]acetamide
CID 55213084
2-[(2-amino-2-oxoethyl)-(2-methylpropyl)amino]-3-methoxypropanoic acid
CID 103224684
3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid
CID 103224638
3-[[ethyl-[2-(ethylamino)-2-oxoethyl]carbamoyl]amino]-2-methoxypropanoic acid
CID 106109940
N-ethyl-2-(2-methoxyethoxy)acetamide
CID 60651065
(2S)-2-(ethylamino)-3-methoxypropanoic acid
CID 149367077
3-methoxy-2-[propyl(2,2,2-trifluoroethyl)amino]propanoic acid
CID 103224693
2-(ethylcarbamoylamino)-3-methoxypropanoic acid
CID 81076919
N-ethyl-2-[2-methylpropyl(propan-2-yl)amino]acetamide
CID 23588498
N-(2-methoxyethyl)-2-[[2-(2-methoxyethylamino)-2-oxoethyl]-pentan-3-ylamino]acetamide
CID 55640369

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid?
The IUPAC name of 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid (CID 103224639) is 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid.
What is the SMILES notation for 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid?
The canonical SMILES for 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid is CCNC(=O)CN(CC)C(COC)C(=O)O.
What is the InChIKey of 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid?
The InChIKey is LKSTYALCZRMFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-4-11-9(13)6-12(5-2)8(7-16-3)10(14)15/h8H,4-7H2,1-3H3,(H,11,13)(H,14,15).
What are the key properties of 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid?
2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid has a molecular weight of 232.28 g/mol, XLogP of -0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]-3-methoxypropanoic acid is sourced from PubChem (CID 103224639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).