methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate

C11H22N2O3 — CID 60721008

IUPACmethyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate
SMILESCCN(CC)C(=O)C(C)N(C)CC(=O)OC
InChIInChI=1S/C11H22N2O3/c1-6-13(7-2)11(15)9(3)12(4)8-10(14)16-5/h9H,6-8H2,1-5H3
InChIKeyMLSGMZSOKUATJU-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.35
Rot. Bonds6

About methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate

methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate (PubChem CID 60721008) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate
PubChem CID60721008
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Namemethyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate
SMILESCCN(CC)C(=O)C(C)N(C)CC(=O)OC
InChIInChI=1S/C11H22N2O3/c1-6-13(7-2)11(15)9(3)12(4)8-10(14)16-5/h9H,6-8H2,1-5H3
InChIKeyMLSGMZSOKUATJU-UHFFFAOYSA-N
XLogP0.35
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate 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

methyl 3-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]propanoate
CID 62011281
methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-propylamino]acetate
CID 62011369
methyl 2-[methyl-[1-oxo-1-(propylamino)propan-2-yl]amino]acetate
CID 60677105
methyl 2-[(3-chloro-2-methylpropanoyl)-ethylamino]acetate
CID 62728356
N,N-diethyl-2-[2-hydroxypropyl(methyl)amino]propanamide
CID 62333186
N,N-diethyl-2-[2-hydroxyethyl(methyl)amino]propanamide
CID 62020446
methyl 2-[4-methoxybutan-2-yl(methyl)amino]acetate
CID 115688695
methyl 2-[[1-(tert-butylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 60677092
methyl 2-[diethylcarbamoyl(methyl)amino]acetate
CID 79161782
methyl 2-[[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 55028897
methyl 2-[[1-(3-methoxypropylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 60720984
2-[3-aminopropyl(methyl)amino]-N,N-diethylpropanamide
CID 43116469

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate?
The IUPAC name of methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate (CID 60721008) is methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate.
What is the SMILES notation for methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate?
The canonical SMILES for methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate is CCN(CC)C(=O)C(C)N(C)CC(=O)OC.
What is the InChIKey of methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate?
The InChIKey is MLSGMZSOKUATJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-6-13(7-2)11(15)9(3)12(4)8-10(14)16-5/h9H,6-8H2,1-5H3.
What are the key properties of methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate?
methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate has a molecular weight of 230.31 g/mol, XLogP of 0.35, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[1-(diethylamino)-1-oxopropan-2-yl]-methylamino]acetate is sourced from PubChem (CID 60721008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).