methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate

C10H18N2O4 — CID 61383689

IUPACmethyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate
SMILESCCN(CC(=O)OC)C(=O)CN(C)C(C)=O
InChIInChI=1S/C10H18N2O4/c1-5-12(7-10(15)16-4)9(14)6-11(3)8(2)13/h5-7H2,1-4H3
InChIKeyGNYFTXAJXOITFD-UHFFFAOYSA-N
MW230.26 g/mol
LogP-0.51
Rot. Bonds5

About methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate

methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate (PubChem CID 61383689) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate
PubChem CID61383689
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Namemethyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate
SMILESCCN(CC(=O)OC)C(=O)CN(C)C(C)=O
InChIInChI=1S/C10H18N2O4/c1-5-12(7-10(15)16-4)9(14)6-11(3)8(2)13/h5-7H2,1-4H3
InChIKeyGNYFTXAJXOITFD-UHFFFAOYSA-N
XLogP-0.51
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate?
The IUPAC name of methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate (CID 61383689) is methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate.
What is the SMILES notation for methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate?
The canonical SMILES for methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate is CCN(CC(=O)OC)C(=O)CN(C)C(C)=O.
What is the InChIKey of methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate?
The InChIKey is GNYFTXAJXOITFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-5-12(7-10(15)16-4)9(14)6-11(3)8(2)13/h5-7H2,1-4H3.
What are the key properties of methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate?
methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate has a molecular weight of 230.26 g/mol, XLogP of -0.51, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate is sourced from PubChem (CID 61383689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).