1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride

C10H15ClF2N4O2 — CID 71272630

IUPAC1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride
SMILESCC(F)(F)c1nc(N2CCC(C(N)=O)CC2)no1.Cl
InChIInChI=1S/C10H14F2N4O2.ClH/c1-10(11,12)8-14-9(15-18-8)16-4-2-6(3-5-16)7(13)17;/h6H,2-5H2,1H3,(H2,13,17);1H
InChIKeyFHELPFLWQHRPGU-UHFFFAOYSA-N
MW296.71 g/mol
LogP1.30
Rot. Bonds3

About 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride

1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride (PubChem CID 71272630) has the molecular formula C10H15ClF2N4O2 and a molecular weight of 296.71 g/mol. Its IUPAC name is 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride
PubChem CID71272630
Molecular FormulaC10H15ClF2N4O2
Molecular Weight296.71 g/mol
Exact Mass296.09
IUPAC Name1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride
SMILESCC(F)(F)c1nc(N2CCC(C(N)=O)CC2)no1.Cl
InChIInChI=1S/C10H14F2N4O2.ClH/c1-10(11,12)8-14-9(15-18-8)16-4-2-6(3-5-16)7(13)17;/h6H,2-5H2,1H3,(H2,13,17);1H
InChIKeyFHELPFLWQHRPGU-UHFFFAOYSA-N
XLogP1.30
TPSA85.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.71
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride 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

1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
CID 44824534
2-(3-pyrrolidin-1-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
CID 116806716
5-tert-butyl-3-(4-propylpiperidin-1-yl)-1,2,4-oxadiazole
CID 143714152
2-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
CID 116807451
N-cyclopentyl-4-[3-[1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidin-4-yl]propoxy]-2-methylbenzamide
CID 58354841
N-methyl-2-(3-pyrrolidin-1-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
CID 116806776
4-[3-[1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidin-4-yl]propoxy]-N-(1-hydroxypropan-2-yl)-2-methylbenzamide
CID 76731075
1-[6-(trifluoromethyl)-2-pyridinyl]piperidine-4-carboxamide
CID 608445
1-(5-methoxypyrimidin-2-yl)piperidine-4-carboxamide
CID 154883318
1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
CID 133366067
4-[3-[1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidin-4-yl]propoxy]-N-(2,3-dihydroxypropyl)-2-methylbenzamide
CID 67319131
1-[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 106769928

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride (CID 71272630) is 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride is CC(F)(F)c1nc(N2CCC(C(N)=O)CC2)no1.Cl.
What is the InChIKey of 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is FHELPFLWQHRPGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N4O2.ClH/c1-10(11,12)8-14-9(15-18-8)16-4-2-6(3-5-16)7(13)17;/h6H,2-5H2,1H3,(H2,13,17);1H.
What are the key properties of 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride?
1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 296.71 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1,1-difluoroethyl)-1,2,4-oxadiazol-3-yl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 71272630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).