1-imidazolidin-1-ylethanone

C5H10N2O — CID 15550259

IUPAC1-imidazolidin-1-ylethanone
SMILESCC(=O)N1CCNC1
InChIInChI=1S/C5H10N2O/c1-5(8)7-3-2-6-4-7/h6H,2-4H2,1H3
InChIKeyDJCMHDGLUZBVHN-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.60
Rot. Bonds

About 1-imidazolidin-1-ylethanone

1-imidazolidin-1-ylethanone (PubChem CID 15550259) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 1-imidazolidin-1-ylethanone.

Molecular Properties

Compound Name1-imidazolidin-1-ylethanone
PubChem CID15550259
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name1-imidazolidin-1-ylethanone
SMILESCC(=O)N1CCNC1
InChIInChI=1S/C5H10N2O/c1-5(8)7-3-2-6-4-7/h6H,2-4H2,1H3
InChIKeyDJCMHDGLUZBVHN-UHFFFAOYSA-N
XLogP-0.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-imidazolidin-1-ylethanone?
The IUPAC name of 1-imidazolidin-1-ylethanone (CID 15550259) is 1-imidazolidin-1-ylethanone.
What is the SMILES notation for 1-imidazolidin-1-ylethanone?
The canonical SMILES for 1-imidazolidin-1-ylethanone is CC(=O)N1CCNC1.
What is the InChIKey of 1-imidazolidin-1-ylethanone?
The InChIKey is DJCMHDGLUZBVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-5(8)7-3-2-6-4-7/h6H,2-4H2,1H3.
What are the key properties of 1-imidazolidin-1-ylethanone?
1-imidazolidin-1-ylethanone has a molecular weight of 114.15 g/mol, XLogP of -0.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazolidin-1-ylethanone is sourced from PubChem (CID 15550259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).