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

C11H13FN2O — CID 105461642

IUPAC5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one
SMILESCCC1CC(=O)N(c2cccc(F)c2)N1
InChIInChI=1S/C11H13FN2O/c1-2-9-7-11(15)14(13-9)10-5-3-4-8(12)6-10/h3-6,9,13H,2,7H2,1H3
InChIKeyABJWRIPJUKTGQX-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.85
Rot. Bonds2

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

5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one (PubChem CID 105461642) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one.

Molecular Properties

Compound Name5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one
PubChem CID105461642
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one
SMILESCCC1CC(=O)N(c2cccc(F)c2)N1
InChIInChI=1S/C11H13FN2O/c1-2-9-7-11(15)14(13-9)10-5-3-4-8(12)6-10/h3-6,9,13H,2,7H2,1H3
InChIKeyABJWRIPJUKTGQX-UHFFFAOYSA-N
XLogP1.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-3-(3-fluorophenyl)-1,3-diazinane-2,4-dione
CID 65221909
3-(3-fluorophenyl)-6-methyl-1,3-diazepane-2,4-dione
CID 81070455
1-ethyl-3-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7546969
1-(3-fluorophenyl)-4-methyl-1,5-diazocan-2-one
CID 117015126
1-(3-fluorophenyl)-5,5-dimethyl-4-(methylaminomethyl)pyrrolidin-2-one
CID 117023360
(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one
CID 26365707
ethyl (3S)-1-(3-fluorophenyl)-5-oxopyrrolidine-3-carboxylate
CID 94075742
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 43971095
1-ethyl-4-(3-fluorophenyl)piperidin-2-one
CID 139936201
1-(3-fluorophenyl)piperidine-2,6-dione
CID 82077412
1-(3-fluorophenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,3-dione
CID 167998872
1-(3-fluorophenyl)-7,7-dimethyl-1,5-diazocan-2-one
CID 117014978

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one?
The IUPAC name of 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one (CID 105461642) is 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one.
What is the SMILES notation for 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one?
The canonical SMILES for 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one is CCC1CC(=O)N(c2cccc(F)c2)N1.
What is the InChIKey of 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one?
The InChIKey is ABJWRIPJUKTGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-2-9-7-11(15)14(13-9)10-5-3-4-8(12)6-10/h3-6,9,13H,2,7H2,1H3.
What are the key properties of 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one?
5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one has a molecular weight of 208.24 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(3-fluorophenyl)pyrazolidin-3-one is sourced from PubChem (CID 105461642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).