ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate

C10H17N3O4 — CID 541647

IUPACethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate
SMILESCCOC(=O)N1CCN(C2COC(=O)N2)CC1
InChIInChI=1S/C10H17N3O4/c1-2-16-10(15)13-5-3-12(4-6-13)8-7-17-9(14)11-8/h8H,2-7H2,1H3,(H,11,14)
InChIKeyGKMVRCYIGVCYNM-UHFFFAOYSA-N
MW243.26 g/mol
LogP-0.17
Rot. Bonds2

About ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate

ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate (PubChem CID 541647) has the molecular formula C10H17N3O4 and a molecular weight of 243.26 g/mol. Its IUPAC name is ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate
PubChem CID541647
Molecular FormulaC10H17N3O4
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Nameethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate
SMILESCCOC(=O)N1CCN(C2COC(=O)N2)CC1
InChIInChI=1S/C10H17N3O4/c1-2-16-10(15)13-5-3-12(4-6-13)8-7-17-9(14)11-8/h8H,2-7H2,1H3,(H,11,14)
InChIKeyGKMVRCYIGVCYNM-UHFFFAOYSA-N
XLogP-0.17
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,3-Dimethyl-1-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]urea
CID 110872094
N-[2-(4-morpholinyl)ethyl]-2-oxo-1-imidazolidinecarboxamide
CID 864666
3-Fluoro-5-(methylamino)-4-morpholin-4-yl-1,3-oxazolidin-2-one
CID 88370944
1,4-Diacetyl-2,3-bis(ethoxycarbonylamino)piperazine
CID 129738469
1,3-Diacetyl-4,5-bis(ethoxycarbonylamino)imidazolidine
CID 129738470
Diethyl (1,3-dimethyl-2-oxo-4,5-imidazolidinediyl)biscarbamate
CID 2841592
ethyl N-(2-morpholin-4-ylethylcarbamoyl)carbamate
CID 4917595
3-[2-(1-Piperazinyl)ethyl]-2-oxazolidinone
CID 12275545
3-[(4-Methylpiperazin-1-yl)methyl]-1,3-oxazolidin-2-one
CID 17785478
3-(Piperazin-1-ylmethyl)-1,3-oxazolidin-2-one
CID 19071096
3-(1-Piperazin-1-ylethyl)-1,3-oxazolidin-2-one
CID 22767881
2-(2-oxoimidazolidin-1-yl)ethyl N-ethoxycarbonyliminocarbamate
CID 68010397

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate?
The IUPAC name of ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate (CID 541647) is ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate.
What is the SMILES notation for ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate?
The canonical SMILES for ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate is CCOC(=O)N1CCN(C2COC(=O)N2)CC1.
What is the InChIKey of ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate?
The InChIKey is GKMVRCYIGVCYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4/c1-2-16-10(15)13-5-3-12(4-6-13)8-7-17-9(14)11-8/h8H,2-7H2,1H3,(H,11,14).
What are the key properties of ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate?
ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate has a molecular weight of 243.26 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(2-oxo-1,3-oxazolidin-4-yl)piperazine-1-carboxylate is sourced from PubChem (CID 541647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).