4-ethoxyimidazol-2-one;formaldehyde;urea

C7H12N4O4 — CID 174844419

IUPAC4-ethoxyimidazol-2-one;formaldehyde;urea
SMILESC=O.CCOC1=NC(=O)N=C1.NC(N)=O
InChIInChI=1S/C5H6N2O2.CH4N2O.CH2O/c1-2-9-4-3-6-5(8)7-4;2-1(3)4;1-2/h3H,2H2,1H3;(H4,2,3,4);1H2
InChIKeyXYTBEGZEBBRREG-UHFFFAOYSA-N
MW216.20 g/mol
LogP-0.54
Rot. Bonds1

About 4-ethoxyimidazol-2-one;formaldehyde;urea

4-ethoxyimidazol-2-one;formaldehyde;urea (PubChem CID 174844419) has the molecular formula C7H12N4O4 and a molecular weight of 216.20 g/mol. Its IUPAC name is 4-ethoxyimidazol-2-one;formaldehyde;urea.

Molecular Properties

Compound Name4-ethoxyimidazol-2-one;formaldehyde;urea
PubChem CID174844419
Molecular FormulaC7H12N4O4
Molecular Weight216.20 g/mol
Exact Mass216.09
IUPAC Name4-ethoxyimidazol-2-one;formaldehyde;urea
SMILESC=O.CCOC1=NC(=O)N=C1.NC(N)=O
InChIInChI=1S/C5H6N2O2.CH4N2O.CH2O/c1-2-9-4-3-6-5(8)7-4;2-1(3)4;1-2/h3H,2H2,1H3;(H4,2,3,4);1H2
InChIKeyXYTBEGZEBBRREG-UHFFFAOYSA-N
XLogP-0.54
TPSA137.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxyimidazol-2-one;formaldehyde;urea?
The IUPAC name of 4-ethoxyimidazol-2-one;formaldehyde;urea (CID 174844419) is 4-ethoxyimidazol-2-one;formaldehyde;urea.
What is the SMILES notation for 4-ethoxyimidazol-2-one;formaldehyde;urea?
The canonical SMILES for 4-ethoxyimidazol-2-one;formaldehyde;urea is C=O.CCOC1=NC(=O)N=C1.NC(N)=O.
What is the InChIKey of 4-ethoxyimidazol-2-one;formaldehyde;urea?
The InChIKey is XYTBEGZEBBRREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2.CH4N2O.CH2O/c1-2-9-4-3-6-5(8)7-4;2-1(3)4;1-2/h3H,2H2,1H3;(H4,2,3,4);1H2.
What are the key properties of 4-ethoxyimidazol-2-one;formaldehyde;urea?
4-ethoxyimidazol-2-one;formaldehyde;urea has a molecular weight of 216.20 g/mol, XLogP of -0.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxyimidazol-2-one;formaldehyde;urea is sourced from PubChem (CID 174844419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).