2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide

C10H16FN3O3S — CID 75375999

IUPAC2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide
SMILESCCn1nc(C)cc1C(=O)NS(=O)(=O)CCCF
InChIInChI=1S/C10H16FN3O3S/c1-3-14-9(7-8(2)12-14)10(15)13-18(16,17)6-4-5-11/h7H,3-6H2,1-2H3,(H,13,15)
InChIKeyZAHAALSUKSMIOT-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.63
Rot. Bonds6

About 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide

2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide (PubChem CID 75375999) has the molecular formula C10H16FN3O3S and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide
PubChem CID75375999
Molecular FormulaC10H16FN3O3S
Molecular Weight277.32 g/mol
Exact Mass277.09
IUPAC Name2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide
SMILESCCn1nc(C)cc1C(=O)NS(=O)(=O)CCCF
InChIInChI=1S/C10H16FN3O3S/c1-3-14-9(7-8(2)12-14)10(15)13-18(16,17)6-4-5-11/h7H,3-6H2,1-2H3,(H,13,15)
InChIKeyZAHAALSUKSMIOT-UHFFFAOYSA-N
XLogP0.63
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide 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

1-ethyl-3-methyl-1H-pyrazole-5-carbonyl isothiocyanate
CID 66120676
1-tert-butyl-5-methyl-N'-methylsulfonylpyrazole-3-carbohydrazide
CID 2809455
1-(2-tert-butyl-5-methylpyrazole-3-carbonyl)-N-cyclopropylsulfonyl-3-methylpyrrolidine-3-carboxamide
CID 46943725
N-{2-[(dimethylamino)sulfonyl]ethyl}-1-ethyl-3-isobutyl-1H-pyrazole-5-carboxamide
CID 70717468
1-(2-tert-butyl-5-methylpyrazole-3-carbonyl)-3-methyl-N-propylsulfonylpyrrolidine-3-carboxamide
CID 46948643
1-methyl-3-(trifluoromethyl)-N-[4-sulfonylphenyl]-1h-pyrazole-5-carboxamide
CID 90775307
1-(1-tert-butyl-5-methylpyrazole-3-carbonyl)-3-methyl-N-propylsulfonylpyrrolidine-3-carboxamide
CID 49778210
1-ethyl-3-isopropyl-N-[2-(1-pyrrolidinylsulfonyl)ethyl]-1H-pyrazole-5-carboxamide
CID 70749295
1-Methyl-3-[(3-sulfanylpropanoylamino)methyl]pyrazole-5-carboxamide
CID 177680673
2-Ethyl-5-isopropyl-N-[2-(2-methylpiperidin-1-ylsulfonyl)ethyl]pyrazole-3-carboxamide
CID 46969110
2-ethyl-N,5-dimethyl-N-propan-2-ylsulfonylpyrazole-3-carboxamide
CID 71859611
N-ethylsulfonyl-2-propan-2-ylpyrazole-3-carboxamide
CID 136515728

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide?
The IUPAC name of 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide (CID 75375999) is 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide.
What is the SMILES notation for 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide?
The canonical SMILES for 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide is CCn1nc(C)cc1C(=O)NS(=O)(=O)CCCF.
What is the InChIKey of 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide?
The InChIKey is ZAHAALSUKSMIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3O3S/c1-3-14-9(7-8(2)12-14)10(15)13-18(16,17)6-4-5-11/h7H,3-6H2,1-2H3,(H,13,15).
What are the key properties of 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide?
2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 0.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(3-fluoropropylsulfonyl)-5-methylpyrazole-3-carboxamide is sourced from PubChem (CID 75375999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).