2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole

C14H12F2N4O2 — CID 19550390

IUPAC2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
SMILESCc1nn(C)cc1-c1nnc(-c2ccccc2OC(F)F)o1
InChIInChI=1S/C14H12F2N4O2/c1-8-10(7-20(2)19-8)13-18-17-12(22-13)9-5-3-4-6-11(9)21-14(15)16/h3-7,14H,1-2H3
InChIKeyWBDOPRRMEVULHR-UHFFFAOYSA-N
MW306.27 g/mol
LogP3.05
Rot. Bonds4

About 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole

2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole (PubChem CID 19550390) has the molecular formula C14H12F2N4O2 and a molecular weight of 306.27 g/mol. Its IUPAC name is 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
PubChem CID19550390
Molecular FormulaC14H12F2N4O2
Molecular Weight306.27 g/mol
Exact Mass306.09
IUPAC Name2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
SMILESCc1nn(C)cc1-c1nnc(-c2ccccc2OC(F)F)o1
InChIInChI=1S/C14H12F2N4O2/c1-8-10(7-20(2)19-8)13-18-17-12(22-13)9-5-3-4-6-11(9)21-14(15)16/h3-7,14H,1-2H3
InChIKeyWBDOPRRMEVULHR-UHFFFAOYSA-N
XLogP3.05
TPSA65.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.27
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole 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-[5-bromo-2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
CID 4866567
2-(1,3-dimethylpyrazol-4-yl)-5-propan-2-yl-1,3,4-oxadiazole
CID 169163056
2-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-oxazole-4-carboxylic acid
CID 62233000
2-(difluoromethoxy)-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 19346092
2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole
CID 170382996
(E)-3-[2-(difluoromethoxy)phenyl]-1-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one
CID 19556546
2-[2-(difluoromethoxy)phenyl]-1,3-dimethylbenzene
CID 151061360
2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole
CID 71227332
5-[2-(difluoromethoxy)phenyl]-2,3-dimethylimidazol-4-amine
CID 62226698
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole
CID 19554513
3-[2-(difluoromethoxy)phenyl]-1-pentan-3-ylpyrazol-4-amine
CID 83203364
[2-[5-(2,6-difluorophenyl)-1,3,4-oxadiazol-2-yl]phenyl] acetate
CID 135391526

Frequently Asked Questions

What is the IUPAC name of 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole (CID 19550390) is 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole is Cc1nn(C)cc1-c1nnc(-c2ccccc2OC(F)F)o1.
What is the InChIKey of 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole?
The InChIKey is WBDOPRRMEVULHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N4O2/c1-8-10(7-20(2)19-8)13-18-17-12(22-13)9-5-3-4-6-11(9)21-14(15)16/h3-7,14H,1-2H3.
What are the key properties of 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole?
2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole has a molecular weight of 306.27 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 19550390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).