3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite

C61H69F4N15O6S — CID 167674021

IUPAC3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite
SMILESCC(C)C(NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CSF
InChIInChI=1S/3C20H22FN5O2.CH3FS/c3*1-11(2)17(20-23-18(25-28-20)13-5-4-6-14(21)9-13)22-19(27)16-10-15(12-7-8-12)24-26(16)3;1-3-2/h3*4-6,9-12,17H,7-8H2,1-3H3,(H,22,27);1H3/t2*17-;;/m10../s1
InChIKeyUNZPPLUROXKRLJ-LEFSJLFRSA-N
MW1216.38 g/mol
LogP12.07
Rot. Bonds18

About 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite

3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite (PubChem CID 167674021) has the molecular formula C61H69F4N15O6S and a molecular weight of 1216.38 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite.

Molecular Properties

Compound Name3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite
PubChem CID167674021
Molecular FormulaC61H69F4N15O6S
Molecular Weight1216.38 g/mol
Exact Mass1215.52
IUPAC Name3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite
SMILESCC(C)C(NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CSF
InChIInChI=1S/3C20H22FN5O2.CH3FS/c3*1-11(2)17(20-23-18(25-28-20)13-5-4-6-14(21)9-13)22-19(27)16-10-15(12-7-8-12)24-26(16)3;1-3-2/h3*4-6,9-12,17H,7-8H2,1-3H3,(H,22,27);1H3/t2*17-;;/m10../s1
InChIKeyUNZPPLUROXKRLJ-LEFSJLFRSA-N
XLogP12.07
TPSA257.52 Ų
H-Bond Donors3
H-Bond Acceptors19
Rotatable Bonds18
Heavy Atoms87
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001216.38
LogP ≤ 512.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1019

Analyze 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite with MolForge

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Related Compounds

3-cyclopropyl-1-methyl-N-[(1S)-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]pyrazole-5-carboxamide
CID 162670628
3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide
CID 164846691
N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-propan-2-ylpyrazole-5-carboxamide
CID 164846702
3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propyl]-1-methylpyrazole-5-carboxamide
CID 164846705
3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methylpyrazole-5-carboxamide
CID 164846708
1-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propyl]-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 164846709
3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methylpyrazole-5-carboxamide
CID 164846714
3-cyclopropyl-N-[cyclopropyl-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-methylpyrazole-5-carboxamide
CID 164846722
N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1-methyl-3-propan-2-ylpyrazole-5-carboxamide
CID 164846735
3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propyl]-1-methylpyrazole-5-carboxamide
CID 164846738
3-cyclopropyl-N-[(R)-cyclopropyl-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-methylpyrazole-5-carboxamide
CID 164846745
3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide
CID 164846757

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite?
The IUPAC name of 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite (CID 167674021) is 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite.
What is the SMILES notation for 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite?
The canonical SMILES for 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite is CC(C)C(NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CC(C)[C@H](NC(=O)c1cc(C2CC2)nn1C)c1nc(-c2cccc(F)c2)no1.CSF.
What is the InChIKey of 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite?
The InChIKey is UNZPPLUROXKRLJ-LEFSJLFRSA-N. The full InChI is InChI=1S/3C20H22FN5O2.CH3FS/c3*1-11(2)17(20-23-18(25-28-20)13-5-4-6-14(21)9-13)22-19(27)16-10-15(12-7-8-12)24-26(16)3;1-3-2/h3*4-6,9-12,17H,7-8H2,1-3H3,(H,22,27);1H3/t2*17-;;/m10../s1.
What are the key properties of 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite?
3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite has a molecular weight of 1216.38 g/mol, XLogP of 12.07, 18 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[(1R)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;3-cyclopropyl-N-[1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl]-1-methylpyrazole-5-carboxamide;methyl thiohypofluorite is sourced from PubChem (CID 167674021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).