1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one

C8H13N3O2 — CID 175896433

IUPAC1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one
SMILESO=C(CN1CCNC1=O)N1CCC1
InChIInChI=1S/C8H13N3O2/c12-7(10-3-1-4-10)6-11-5-2-9-8(11)13/h1-6H2,(H,9,13)
InChIKeyMHFGOHFWAIKLIL-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.76
Rot. Bonds2

About 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one

1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one (PubChem CID 175896433) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one
PubChem CID175896433
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one
SMILESO=C(CN1CCNC1=O)N1CCC1
InChIInChI=1S/C8H13N3O2/c12-7(10-3-1-4-10)6-11-5-2-9-8(11)13/h1-6H2,(H,9,13)
InChIKeyMHFGOHFWAIKLIL-UHFFFAOYSA-N
XLogP-0.76
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one (CID 175896433) is 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one is O=C(CN1CCNC1=O)N1CCC1.
What is the InChIKey of 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one?
The InChIKey is MHFGOHFWAIKLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c12-7(10-3-1-4-10)6-11-5-2-9-8(11)13/h1-6H2,(H,9,13).
What are the key properties of 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one?
1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one has a molecular weight of 183.21 g/mol, XLogP of -0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(azetidin-1-yl)-2-oxoethyl]imidazolidin-2-one is sourced from PubChem (CID 175896433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).