(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone

C19H20FN5O2 — CID 11187804

IUPAC(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
SMILESCc1cc(C(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)nn1C
InChIInChI=1S/C19H20FN5O2/c1-12-10-16(22-24(12)2)19(26)25-9-3-4-14(11-25)18-21-17(23-27-18)13-5-7-15(20)8-6-13/h5-8,10,14H,3-4,9,11H2,1-2H3/t14-/m0/s1
InChIKeyPSZICAUUIXXCES-AWEZNQCLSA-N
MW369.40 g/mol
LogP2.94
Rot. Bonds3

About (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone

(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone (PubChem CID 11187804) has the molecular formula C19H20FN5O2 and a molecular weight of 369.40 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
PubChem CID11187804
Molecular FormulaC19H20FN5O2
Molecular Weight369.40 g/mol
Exact Mass369.16
IUPAC Name(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
SMILESCc1cc(C(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)nn1C
InChIInChI=1S/C19H20FN5O2/c1-12-10-16(22-24(12)2)19(26)25-9-3-4-14(11-25)18-21-17(23-27-18)13-5-7-15(20)8-6-13/h5-8,10,14H,3-4,9,11H2,1-2H3/t14-/m0/s1
InChIKeyPSZICAUUIXXCES-AWEZNQCLSA-N
XLogP2.94
TPSA77.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-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

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?
The IUPAC name of (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone (CID 11187804) is (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone.
What is the SMILES notation for (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?
The canonical SMILES for (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone is Cc1cc(C(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)nn1C.
What is the InChIKey of (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?
The InChIKey is PSZICAUUIXXCES-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H20FN5O2/c1-12-10-16(22-24(12)2)19(26)25-9-3-4-14(11-25)18-21-17(23-27-18)13-5-7-15(20)8-6-13/h5-8,10,14H,3-4,9,11H2,1-2H3/t14-/m0/s1.
What are the key properties of (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone?
(1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone has a molecular weight of 369.40 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-3-yl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 11187804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).