3-(ethylamino)azetidin-2-one

C5H10N2O — CID 123769007

IUPAC3-(ethylamino)azetidin-2-one
SMILESCCNC1CNC1=O
InChIInChI=1S/C5H10N2O/c1-2-6-4-3-7-5(4)8/h4,6H,2-3H2,1H3,(H,7,8)
InChIKeyZCHLIENUNHHNSJ-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.91
Rot. Bonds2

About 3-(ethylamino)azetidin-2-one

3-(ethylamino)azetidin-2-one (PubChem CID 123769007) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 3-(ethylamino)azetidin-2-one.

Molecular Properties

Compound Name3-(ethylamino)azetidin-2-one
PubChem CID123769007
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name3-(ethylamino)azetidin-2-one
SMILESCCNC1CNC1=O
InChIInChI=1S/C5H10N2O/c1-2-6-4-3-7-5(4)8/h4,6H,2-3H2,1H3,(H,7,8)
InChIKeyZCHLIENUNHHNSJ-UHFFFAOYSA-N
XLogP-0.91
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)azetidin-2-one?
The IUPAC name of 3-(ethylamino)azetidin-2-one (CID 123769007) is 3-(ethylamino)azetidin-2-one.
What is the SMILES notation for 3-(ethylamino)azetidin-2-one?
The canonical SMILES for 3-(ethylamino)azetidin-2-one is CCNC1CNC1=O.
What is the InChIKey of 3-(ethylamino)azetidin-2-one?
The InChIKey is ZCHLIENUNHHNSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-2-6-4-3-7-5(4)8/h4,6H,2-3H2,1H3,(H,7,8).
What are the key properties of 3-(ethylamino)azetidin-2-one?
3-(ethylamino)azetidin-2-one has a molecular weight of 114.15 g/mol, XLogP of -0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)azetidin-2-one is sourced from PubChem (CID 123769007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).