3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide

C11H11F2N3O2S — CID 71867365

IUPAC3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
SMILESCCc1cc(NC(=O)c2sccc2OC(F)F)n[nH]1
InChIInChI=1S/C11H11F2N3O2S/c1-2-6-5-8(16-15-6)14-10(17)9-7(3-4-19-9)18-11(12)13/h3-5,11H,2H2,1H3,(H2,14,15,16,17)
InChIKeyMFNNBFLVRPRHID-UHFFFAOYSA-N
MW287.29 g/mol
LogP2.89
Rot. Bonds5

About 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide

3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide (PubChem CID 71867365) has the molecular formula C11H11F2N3O2S and a molecular weight of 287.29 g/mol. Its IUPAC name is 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
PubChem CID71867365
Molecular FormulaC11H11F2N3O2S
Molecular Weight287.29 g/mol
Exact Mass287.05
IUPAC Name3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
SMILESCCc1cc(NC(=O)c2sccc2OC(F)F)n[nH]1
InChIInChI=1S/C11H11F2N3O2S/c1-2-6-5-8(16-15-6)14-10(17)9-7(3-4-19-9)18-11(12)13/h3-5,11H,2H2,1H3,(H2,14,15,16,17)
InChIKeyMFNNBFLVRPRHID-UHFFFAOYSA-N
XLogP2.89
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(difluoromethoxy)-N-[5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl]-5-methylthiophene-2-carboxamide
CID 99811100
3-methyl-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
CID 47148561
N-(5-ethyl-1H-pyrazol-3-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 112687120
3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
CID 80641240
3-[(3-ethylthiophene-2-carbonyl)amino]-1H-pyrazole-5-carboxylic acid
CID 64526870
3-(difluoromethoxy)-N-(2-ethyl-2-hydroxybutyl)thiophene-2-carboxamide
CID 111463271
4-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 47423237
N-(5-ethyl-1H-pyrazol-3-yl)-2-fluorobenzamide
CID 47423207
N-[5-(cyclohexylmethyl)-1H-pyrazol-3-yl]-3-(difluoromethoxy)-4-methoxybenzamide
CID 56553284
N-(5-ethyl-1H-pyrazol-3-yl)-5-fluoro-2-hydroxybenzamide
CID 112697504
3-(difluoromethoxy)-N-(3-hydroxybutyl)thiophene-2-carboxamide
CID 111433716
N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
CID 104619581

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide (CID 71867365) is 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide is CCc1cc(NC(=O)c2sccc2OC(F)F)n[nH]1.
What is the InChIKey of 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
The InChIKey is MFNNBFLVRPRHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3O2S/c1-2-6-5-8(16-15-6)14-10(17)9-7(3-4-19-9)18-11(12)13/h3-5,11H,2H2,1H3,(H2,14,15,16,17).
What are the key properties of 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide?
3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide has a molecular weight of 287.29 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 71867365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).