methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate

C10H18N2O3 — CID 116982594

IUPACmethyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate
SMILESCCC1CN(CCC(=O)OC)C(=O)N1C
InChIInChI=1S/C10H18N2O3/c1-4-8-7-12(10(14)11(8)2)6-5-9(13)15-3/h8H,4-7H2,1-3H3
InChIKeyMTPIWSZTSXGLCR-UHFFFAOYSA-N
MW214.26 g/mol
LogP0.70
Rot. Bonds4

About methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate

methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate (PubChem CID 116982594) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate.

Molecular Properties

Compound Namemethyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate
PubChem CID116982594
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Namemethyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate
SMILESCCC1CN(CCC(=O)OC)C(=O)N1C
InChIInChI=1S/C10H18N2O3/c1-4-8-7-12(10(14)11(8)2)6-5-9(13)15-3/h8H,4-7H2,1-3H3
InChIKeyMTPIWSZTSXGLCR-UHFFFAOYSA-N
XLogP0.70
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate?
The IUPAC name of methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate (CID 116982594) is methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate.
What is the SMILES notation for methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate?
The canonical SMILES for methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate is CCC1CN(CCC(=O)OC)C(=O)N1C.
What is the InChIKey of methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate?
The InChIKey is MTPIWSZTSXGLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-4-8-7-12(10(14)11(8)2)6-5-9(13)15-3/h8H,4-7H2,1-3H3.
What are the key properties of methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate?
methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate has a molecular weight of 214.26 g/mol, XLogP of 0.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(4-ethyl-3-methyl-2-oxoimidazolidin-1-yl)propanoate is sourced from PubChem (CID 116982594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).