ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate

C10H20N2O3 — CID 103096935

IUPACethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate
SMILESCCOC(=O)CNCC(C)(C)C(=O)NC
InChIInChI=1S/C10H20N2O3/c1-5-15-8(13)6-12-7-10(2,3)9(14)11-4/h12H,5-7H2,1-4H3,(H,11,14)
InChIKeyMJUPKXLGHZQCAC-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.09
Rot. Bonds6

About ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate

ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate (PubChem CID 103096935) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate
PubChem CID103096935
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Nameethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate
SMILESCCOC(=O)CNCC(C)(C)C(=O)NC
InChIInChI=1S/C10H20N2O3/c1-5-15-8(13)6-12-7-10(2,3)9(14)11-4/h12H,5-7H2,1-4H3,(H,11,14)
InChIKeyMJUPKXLGHZQCAC-UHFFFAOYSA-N
XLogP-0.09
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]carbamoylamino]acetate
CID 113278352
3-(2-ethoxyethylamino)-N,2,2-trimethylpropanamide
CID 106277468
ethyl 2-(2,2-dimethylpentylamino)acetate
CID 115257590
ethyl 2-(2,2,3-trimethylbutylamino)acetate
CID 107095555
ethyl 2-amino-3-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]-3-oxopropanoate
CID 114167338
3-[[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]amino]-N,2,2-trimethylpropanamide
CID 106277417
3-(3,3-dimethylbutylamino)-N,2,2-trimethylpropanamide
CID 102672659
methyl 2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]acetate
CID 106276443
(2-ethoxy-2-oxoethyl)carbamic acid
CID 18800943
ethyl 2-[[2-methyl-2-(5-methylfuran-2-yl)propyl]amino]acetate
CID 115257618
ethyl 2-(2-carbamoyloxyethylamino)acetate
CID 83209785
3-(2-methoxypropylamino)-N,2,2-trimethylpropanamide
CID 106276968

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate?
The IUPAC name of ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate (CID 103096935) is ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate?
The canonical SMILES for ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate is CCOC(=O)CNCC(C)(C)C(=O)NC.
What is the InChIKey of ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate?
The InChIKey is MJUPKXLGHZQCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-5-15-8(13)6-12-7-10(2,3)9(14)11-4/h12H,5-7H2,1-4H3,(H,11,14).
What are the key properties of ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate?
ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate has a molecular weight of 216.28 g/mol, XLogP of -0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]acetate is sourced from PubChem (CID 103096935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).