tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate

C10H19N3O4 — CID 178023400

IUPACtert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate
SMILESCC(C)(C)OC(=O)NCCON1CCNC1=O
InChIInChI=1S/C10H19N3O4/c1-10(2,3)17-9(15)12-5-7-16-13-6-4-11-8(13)14/h4-7H2,1-3H3,(H,11,14)(H,12,15)
InChIKeyVNBHNAZCRYXUQV-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.47
Rot. Bonds4

About tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate

tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate (PubChem CID 178023400) has the molecular formula C10H19N3O4 and a molecular weight of 245.28 g/mol. Its IUPAC name is tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate
PubChem CID178023400
Molecular FormulaC10H19N3O4
Molecular Weight245.28 g/mol
Exact Mass245.14
IUPAC Nametert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate
SMILESCC(C)(C)OC(=O)NCCON1CCNC1=O
InChIInChI=1S/C10H19N3O4/c1-10(2,3)17-9(15)12-5-7-16-13-6-4-11-8(13)14/h4-7H2,1-3H3,(H,11,14)(H,12,15)
InChIKeyVNBHNAZCRYXUQV-UHFFFAOYSA-N
XLogP0.47
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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tert-butyl N-[2-[[3-(2-oxoimidazolidin-1-yl)benzoyl]amino]ethyl]carbamate
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tert-butyl N-(4-piperazin-1-ylbutyl)carbamate
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tert-butyl N-(2-carbamoyloxyethyl)carbamate
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tert-butyl N-[2-(1,4-diazepane-1-carbothioylamino)ethyl]carbamate
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tert-butyl N-[(2-oxopyrrolidin-3-yl)methyl]carbamate
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tert-butyl N-(4-oxo-4-piperazin-1-ylbutyl)carbamate
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tert-butyl N-[2-(12,13,25,26-tetrabutoxy-2,10,15,23-tetraoxo-19-propyl-3,6,9,16,19,22-hexazatricyclo[22.2.2.211,14]triaconta-1(26),11,13,24,27,29-hexaen-6-yl)ethyl]carbamate
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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate?
The IUPAC name of tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate (CID 178023400) is tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate?
The canonical SMILES for tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate is CC(C)(C)OC(=O)NCCON1CCNC1=O.
What is the InChIKey of tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate?
The InChIKey is VNBHNAZCRYXUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O4/c1-10(2,3)17-9(15)12-5-7-16-13-6-4-11-8(13)14/h4-7H2,1-3H3,(H,11,14)(H,12,15).
What are the key properties of tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate?
tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate has a molecular weight of 245.28 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-(2-oxoimidazolidin-1-yl)oxyethyl]carbamate is sourced from PubChem (CID 178023400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).