methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate

C11H24N2O3 — CID 63055174

IUPACmethyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
SMILESCCN(CCOC)CCC(NC)C(=O)OC
InChIInChI=1S/C11H24N2O3/c1-5-13(8-9-15-3)7-6-10(12-2)11(14)16-4/h10,12H,5-9H2,1-4H3
InChIKeyOPQZCRAAHYUUER-UHFFFAOYSA-N
MW232.32 g/mol
LogP0.11
Rot. Bonds9

About methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate

methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate (PubChem CID 63055174) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate.

Molecular Properties

Compound Namemethyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
PubChem CID63055174
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Namemethyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
SMILESCCN(CCOC)CCC(NC)C(=O)OC
InChIInChI=1S/C11H24N2O3/c1-5-13(8-9-15-3)7-6-10(12-2)11(14)16-4/h10,12H,5-9H2,1-4H3
InChIKeyOPQZCRAAHYUUER-UHFFFAOYSA-N
XLogP0.11
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[butyl(ethyl)amino]-2-(methylamino)butanoate
CID 63028145
methyl 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanoate
CID 63029585
ethyl 4-[ethyl(propyl)amino]-2-(methylamino)butanoate
CID 63028830
methyl 4-[cyclopropyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
CID 55145669
2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide
CID 63054468
methyl 2-acetamido-3-[ethyl(2-methoxyethyl)amino]propanoate
CID 65475175
methyl 3-[2-ethoxyethyl(ethyl)amino]-2-(methylamino)propanoate
CID 63690523
2-[ethyl(2-methoxyethyl)amino]ethyl 2-methylpropanoate
CID 89149379
methyl 2-bromo-3-[ethyl(2-methoxyethyl)amino]propanoate
CID 81099300
methyl 2-(methylamino)-4-[methyl(pentan-2-yl)amino]butanoate
CID 63055628
methyl 3-[bis(2-methoxyethyl)amino]-2-methylpropanoate
CID 60649296
methyl 4-(2-methoxyethylsulfanyl)-2-(methylamino)butanoate
CID 63033198

Frequently Asked Questions

What is the IUPAC name of methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate?
The IUPAC name of methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate (CID 63055174) is methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate.
What is the SMILES notation for methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate?
The canonical SMILES for methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate is CCN(CCOC)CCC(NC)C(=O)OC.
What is the InChIKey of methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate?
The InChIKey is OPQZCRAAHYUUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-5-13(8-9-15-3)7-6-10(12-2)11(14)16-4/h10,12H,5-9H2,1-4H3.
What are the key properties of methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate?
methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate has a molecular weight of 232.32 g/mol, XLogP of 0.11, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate is sourced from PubChem (CID 63055174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).