5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one

C8H16N2O2 — CID 105435164

IUPAC5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
SMILESCCC1CC(=O)N(CC(C)O)N1
InChIInChI=1S/C8H16N2O2/c1-3-7-4-8(12)10(9-7)5-6(2)11/h6-7,9,11H,3-5H2,1-2H3
InChIKeyLZHYKCPKXGDMCM-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.12
Rot. Bonds3

About 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one

5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one (PubChem CID 105435164) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one.

Molecular Properties

Compound Name5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
PubChem CID105435164
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
SMILESCCC1CC(=O)N(CC(C)O)N1
InChIInChI=1S/C8H16N2O2/c1-3-7-4-8(12)10(9-7)5-6(2)11/h6-7,9,11H,3-5H2,1-2H3
InChIKeyLZHYKCPKXGDMCM-UHFFFAOYSA-N
XLogP-0.12
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-hydroxy-2-methylpropyl)-5-methylpyrazolidin-3-one
CID 105435152
5-tert-butyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
CID 105467971
5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
CID 105451618
5-ethyl-3-[(2S)-2-hydroxypropyl]imidazolidine-2,4-dione
CID 131041674
5-cyclobutyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
CID 105466140
5-ethyl-1-[(2R)-2-hydroxypropyl]azepan-2-one
CID 103935391
1-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
CID 105435195
1-[(2S)-2-hydroxypropyl]piperazin-2-one
CID 96979456
5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one
CID 105461642
(2S)-1-[(2S)-2-ethylpiperazin-1-yl]propan-2-ol
CID 98219220
1-[(2R)-2-hydroxypropyl]-5-propylazepan-2-one
CID 103935393
(4S)-4-(1-hydroxypropyl)azetidin-2-one
CID 18638683

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one?
The IUPAC name of 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one (CID 105435164) is 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one.
What is the SMILES notation for 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one?
The canonical SMILES for 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one is CCC1CC(=O)N(CC(C)O)N1.
What is the InChIKey of 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one?
The InChIKey is LZHYKCPKXGDMCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-3-7-4-8(12)10(9-7)5-6(2)11/h6-7,9,11H,3-5H2,1-2H3.
What are the key properties of 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one?
5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one has a molecular weight of 172.23 g/mol, XLogP of -0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one is sourced from PubChem (CID 105435164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).