ethyl 2-(2-ethoxypropylcarbamoylamino)acetate

C10H20N2O4 — CID 115664872

IUPACethyl 2-(2-ethoxypropylcarbamoylamino)acetate
SMILESCCOC(=O)CNC(=O)NCC(C)OCC
InChIInChI=1S/C10H20N2O4/c1-4-15-8(3)6-11-10(14)12-7-9(13)16-5-2/h8H,4-7H2,1-3H3,(H2,11,12,14)
InChIKeyFTQMKBDWUHVHEP-UHFFFAOYSA-N
MW232.28 g/mol
LogP0.27
Rot. Bonds7

About ethyl 2-(2-ethoxypropylcarbamoylamino)acetate

ethyl 2-(2-ethoxypropylcarbamoylamino)acetate (PubChem CID 115664872) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is ethyl 2-(2-ethoxypropylcarbamoylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(2-ethoxypropylcarbamoylamino)acetate
PubChem CID115664872
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Nameethyl 2-(2-ethoxypropylcarbamoylamino)acetate
SMILESCCOC(=O)CNC(=O)NCC(C)OCC
InChIInChI=1S/C10H20N2O4/c1-4-15-8(3)6-11-10(14)12-7-9(13)16-5-2/h8H,4-7H2,1-3H3,(H2,11,12,14)
InChIKeyFTQMKBDWUHVHEP-UHFFFAOYSA-N
XLogP0.27
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(2,3-dimethylbutylcarbamoylamino)acetate
CID 64597443
1-butyl-3-(2-ethoxypropyl)urea
CID 115660949
ethyl 2-(2,2,2-trifluoroethylcarbamoylamino)acetate
CID 43384954
ethyl 2-(2-ethoxypropylamino)propanoate
CID 115663940
methyl N-(2-ethoxypropyl)carbamate
CID 115649304
ethyl 2-(2-methylpentan-3-ylcarbamoylamino)acetate
CID 61471057
(2-ethoxy-2-oxoethyl)carbamic acid
CID 18800943
3-[(2-ethoxy-2-oxoethyl)carbamoylamino]propanoic acid
CID 14949744
3-[(2-ethoxy-2-oxoethyl)carbamoylamino]-2,2-dimethylpropanoic acid
CID 115428456
1-(2-ethoxypropyl)-3-(4-methylphenyl)urea
CID 121261528
ethyl 2-[(2R)-1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]oxyacetate
CID 87219615
ethyl 2-[(1-amino-3-methyl-1-oxobutan-2-yl)carbamoylamino]acetate
CID 106346911

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-ethoxypropylcarbamoylamino)acetate?
The IUPAC name of ethyl 2-(2-ethoxypropylcarbamoylamino)acetate (CID 115664872) is ethyl 2-(2-ethoxypropylcarbamoylamino)acetate.
What is the SMILES notation for ethyl 2-(2-ethoxypropylcarbamoylamino)acetate?
The canonical SMILES for ethyl 2-(2-ethoxypropylcarbamoylamino)acetate is CCOC(=O)CNC(=O)NCC(C)OCC.
What is the InChIKey of ethyl 2-(2-ethoxypropylcarbamoylamino)acetate?
The InChIKey is FTQMKBDWUHVHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-4-15-8(3)6-11-10(14)12-7-9(13)16-5-2/h8H,4-7H2,1-3H3,(H2,11,12,14).
What are the key properties of ethyl 2-(2-ethoxypropylcarbamoylamino)acetate?
ethyl 2-(2-ethoxypropylcarbamoylamino)acetate has a molecular weight of 232.28 g/mol, XLogP of 0.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-ethoxypropylcarbamoylamino)acetate is sourced from PubChem (CID 115664872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).