N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide

C10H17N3O3S — CID 113433748

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide
SMILESCCc1cc(NC(=O)C(C)(C)S(C)(=O)=O)n[nH]1
InChIInChI=1S/C10H17N3O3S/c1-5-7-6-8(13-12-7)11-9(14)10(2,3)17(4,15)16/h6H,5H2,1-4H3,(H2,11,12,13,14)
InChIKeyLTGDXVSQKBMQLM-UHFFFAOYSA-N
MW259.33 g/mol
LogP0.73
Rot. Bonds4

About N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide

N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide (PubChem CID 113433748) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide
PubChem CID113433748
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide
SMILESCCc1cc(NC(=O)C(C)(C)S(C)(=O)=O)n[nH]1
InChIInChI=1S/C10H17N3O3S/c1-5-7-6-8(13-12-7)11-9(14)10(2,3)17(4,15)16/h6H,5H2,1-4H3,(H2,11,12,13,14)
InChIKeyLTGDXVSQKBMQLM-UHFFFAOYSA-N
XLogP0.73
TPSA91.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide 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

(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
2-tert-butylsulfanyl-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593811
N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide
CID 104620650
N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-2-methylsulfonylpropanamide
CID 104620236
N-(5-ethyl-1H-pyrazol-3-yl)-2H-triazole-4-carboxamide
CID 47423483
1-ethyl-3-(5-ethyl-1H-pyrazol-3-yl)-1-methylurea
CID 104620385
N-(5-ethyl-1H-pyrazol-3-yl)-3-methylsulfanylpropanamide
CID 115593810
2-[2-[(5-ethyl-1H-pyrazol-3-yl)amino]-2-oxoethoxy]acetic acid
CID 104617294
N-(5-ethyl-1H-pyrazol-3-yl)cyclopent-3-ene-1-carboxamide
CID 115644958
(2R)-2-amino-N-(5-ethyl-1H-pyrazol-3-yl)butanamide
CID 104617946
N-(5-ethyl-1H-pyrazol-3-yl)-3-methylpentanamide
CID 114875544
2-amino-N-[5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl]-2-methylpropanamide
CID 119329402

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide (CID 113433748) is N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide is CCc1cc(NC(=O)C(C)(C)S(C)(=O)=O)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide?
The InChIKey is LTGDXVSQKBMQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-5-7-6-8(13-12-7)11-9(14)10(2,3)17(4,15)16/h6H,5H2,1-4H3,(H2,11,12,13,14).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide?
N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide has a molecular weight of 259.33 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-2-methyl-2-methylsulfonylpropanamide is sourced from PubChem (CID 113433748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).