5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole

C10H11F2N3O — CID 170408968

IUPAC5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole
SMILESCc1cc(-c2ccno2)nn1CC(C)(F)F
InChIInChI=1S/C10H11F2N3O/c1-7-5-8(9-3-4-13-16-9)14-15(7)6-10(2,11)12/h3-5H,6H2,1-2H3
InChIKeyOZFGEVYQDBQRHM-UHFFFAOYSA-N
MW227.21 g/mol
LogP2.50
Rot. Bonds3

About 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole

5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole (PubChem CID 170408968) has the molecular formula C10H11F2N3O and a molecular weight of 227.21 g/mol. Its IUPAC name is 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole.

Molecular Properties

Compound Name5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole
PubChem CID170408968
Molecular FormulaC10H11F2N3O
Molecular Weight227.21 g/mol
Exact Mass227.09
IUPAC Name5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole
SMILESCc1cc(-c2ccno2)nn1CC(C)(F)F
InChIInChI=1S/C10H11F2N3O/c1-7-5-8(9-3-4-13-16-9)14-15(7)6-10(2,11)12/h3-5H,6H2,1-2H3
InChIKeyOZFGEVYQDBQRHM-UHFFFAOYSA-N
XLogP2.50
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.21
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole 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

Cyanoimino-[1,5-dimethyl-3-(3-methyl-1,2-oxazol-5-yl)pyrazol-4-yl]-oxidoazanium
CID 54586770
5-(1-Ethyl-1H-pyrazol-3-YL)isoxazole-3-carboxylic acid
CID 19620908
7,7-Dimethyl-3-(1,2-oxazol-5-yl)-1-(2,2,2-trifluoroethyl)-5,6-dihydroindazol-4-one
CID 22732979
5-[4-[1-Methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]-1,2-oxazole
CID 69395912
3-(1-Methyl-1H-pyrazol-5-yl)-5-[4-(trifluoromethyl)phenyl]-1,2-oxazole
CID 86684877
5-(4-Iodo-2-methylpyrazol-3-yl)-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole
CID 89558691
3-[2-(3,3,3-Trifluoropropyl)pyrazol-3-yl]-1,2-oxazole
CID 141427955
3-[1-(3,3,3-Trifluoropropyl)pyrazol-3-yl]-1,2-oxazole
CID 141427963
5-[5-Methyl-1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-1,2-oxazole
CID 170409590
Ethane;5-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-1,2-oxazole
CID 177229996
5-(1,5-dimethyl-1H-pyrazol-4-yl)isoxazole
CID 7016452
5-(1-methylpyrazol-3-yl)-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 138016935

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole?
The IUPAC name of 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole (CID 170408968) is 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole.
What is the SMILES notation for 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole?
The canonical SMILES for 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole is Cc1cc(-c2ccno2)nn1CC(C)(F)F.
What is the InChIKey of 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole?
The InChIKey is OZFGEVYQDBQRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2N3O/c1-7-5-8(9-3-4-13-16-9)14-15(7)6-10(2,11)12/h3-5H,6H2,1-2H3.
What are the key properties of 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole?
5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole has a molecular weight of 227.21 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2,2-difluoropropyl)-5-methylpyrazol-3-yl]-1,2-oxazole is sourced from PubChem (CID 170408968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).