3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite

C56H70F7N15O6S — CID 167568903

IUPAC3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite
SMILESC.C.C.C.CSF.Cc1cccc(-c2noc(C(C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1
InChIInChI=1S/3C17H17F2N5O2.CH3FS.4CH4/c3*1-9-5-4-6-11(7-9)15-21-17(26-23-15)10(2)20-16(25)13-8-12(14(18)19)22-24(13)3;1-3-2;;;;/h3*4-8,10,14H,1-3H3,(H,20,25);1H3;4*1H4/t2*10-;;;;;;/m10....../s1
InChIKeyFQFJVWVPHWLOFV-SYIBRYFOSA-N
MW1214.33 g/mol
LogP13.40
Rot. Bonds15

About 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite

3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite (PubChem CID 167568903) has the molecular formula C56H70F7N15O6S and a molecular weight of 1214.33 g/mol. Its IUPAC name is 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite.

Molecular Properties

Compound Name3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite
PubChem CID167568903
Molecular FormulaC56H70F7N15O6S
Molecular Weight1214.33 g/mol
Exact Mass1213.52
IUPAC Name3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite
SMILESC.C.C.C.CSF.Cc1cccc(-c2noc(C(C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1
InChIInChI=1S/3C17H17F2N5O2.CH3FS.4CH4/c3*1-9-5-4-6-11(7-9)15-21-17(26-23-15)10(2)20-16(25)13-8-12(14(18)19)22-24(13)3;1-3-2;;;;/h3*4-8,10,14H,1-3H3,(H,20,25);1H3;4*1H4/t2*10-;;;;;;/m10....../s1
InChIKeyFQFJVWVPHWLOFV-SYIBRYFOSA-N
XLogP13.40
TPSA257.52 Ų
H-Bond Donors3
H-Bond Acceptors19
Rotatable Bonds15
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001214.33
LogP ≤ 513.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1019

Analyze 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite 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

N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271902
3-ethyl-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide
CID 162665533
N-[1-[3-(3-carbamoylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271751
N-[1-[3-[3-(dimethylcarbamoyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271761
N-[2-amino-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271795
N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271903
N-[1-[3-[3-(cyanomethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155271978
N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 155272198
1-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propyl]-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 164846709
3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide
CID 164846713
N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 164846717
2-(difluoromethyl)-5-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-3-carboxamide
CID 164846729

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite?
The IUPAC name of 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite (CID 167568903) is 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite.
What is the SMILES notation for 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite?
The canonical SMILES for 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite is C.C.C.C.CSF.Cc1cccc(-c2noc(C(C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.Cc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C(F)F)nn3C)n2)c1.
What is the InChIKey of 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite?
The InChIKey is FQFJVWVPHWLOFV-SYIBRYFOSA-N. The full InChI is InChI=1S/3C17H17F2N5O2.CH3FS.4CH4/c3*1-9-5-4-6-11(7-9)15-21-17(26-23-15)10(2)20-16(25)13-8-12(14(18)19)22-24(13)3;1-3-2;;;;/h3*4-8,10,14H,1-3H3,(H,20,25);1H3;4*1H4/t2*10-;;;;;;/m10....../s1.
What are the key properties of 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite?
3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite has a molecular weight of 1214.33 g/mol, XLogP of 13.40, 15 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-1-methyl-N-[(1S)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[(1R)-1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;3-(difluoromethyl)-1-methyl-N-[1-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrazole-5-carboxamide;methane;methyl thiohypofluorite is sourced from PubChem (CID 167568903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).