(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone

C17H24FN3O — CID 52989207

IUPAC(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone
SMILESCCC1CCCCN1C(=O)C1CC(c2ccc(F)cc2)NN1
InChIInChI=1S/C17H24FN3O/c1-2-14-5-3-4-10-21(14)17(22)16-11-15(19-20-16)12-6-8-13(18)9-7-12/h6-9,14-16,19-20H,2-5,10-11H2,1H3
InChIKeyJTHVJZPVXYHZSZ-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.52
Rot. Bonds3

About (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone

(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone (PubChem CID 52989207) has the molecular formula C17H24FN3O and a molecular weight of 305.40 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone
PubChem CID52989207
Molecular FormulaC17H24FN3O
Molecular Weight305.40 g/mol
Exact Mass305.19
IUPAC Name(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone
SMILESCCC1CCCCN1C(=O)C1CC(c2ccc(F)cc2)NN1
InChIInChI=1S/C17H24FN3O/c1-2-14-5-3-4-10-21(14)17(22)16-11-15(19-20-16)12-6-8-13(18)9-7-12/h6-9,14-16,19-20H,2-5,10-11H2,1H3
InChIKeyJTHVJZPVXYHZSZ-UHFFFAOYSA-N
XLogP2.52
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone 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

(2-ethylpiperidin-1-yl)-[2-(4-fluorophenyl)cyclopropyl]methanone
CID 134055510
4-(2-ethylpiperidine-1-carbonyl)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 109150013
2-(2-ethylpiperidin-1-yl)-N-(4-fluorophenyl)-2-oxoacetamide
CID 47336169
(4-aminopiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone
CID 77115341
(2-ethylpiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 61154160
(2-ethylpiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103793731
(2-ethylpiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 104912723
(2-ethylpiperidin-1-yl)-[3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanone
CID 20869140
[2-(4-fluorophenyl)pyrrolidin-1-yl]-(5-thiophen-2-ylpyrazolidin-3-yl)methanone
CID 134028124
[(2R)-2-ethylpiperidin-1-yl]-[(1S,2R)-2-phenylcyclopropyl]methanone
CID 124714524
[5-(4-fluorophenyl)pyrazolidin-3-yl]-[4-(2-methylpropylsulfonyl)piperidin-1-yl]methanone
CID 133108632
(2-ethylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 56831896

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone (CID 52989207) is (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone is CCC1CCCCN1C(=O)C1CC(c2ccc(F)cc2)NN1.
What is the InChIKey of (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone?
The InChIKey is JTHVJZPVXYHZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN3O/c1-2-14-5-3-4-10-21(14)17(22)16-11-15(19-20-16)12-6-8-13(18)9-7-12/h6-9,14-16,19-20H,2-5,10-11H2,1H3.
What are the key properties of (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone?
(2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone has a molecular weight of 305.40 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-[5-(4-fluorophenyl)pyrazolidin-3-yl]methanone is sourced from PubChem (CID 52989207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).