2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide

C14H20N4O2S — CID 122556150

IUPAC2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide
SMILESCCC(NS(=O)(=O)c1ccnn1CC)c1cc(C)ccn1
InChIInChI=1S/C14H20N4O2S/c1-4-12(13-10-11(3)6-8-15-13)17-21(19,20)14-7-9-16-18(14)5-2/h6-10,12,17H,4-5H2,1-3H3
InChIKeyZLZNAABRZUQTNL-UHFFFAOYSA-N
MW308.41 g/mol
LogP2.04
Rot. Bonds6

About 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide

2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide (PubChem CID 122556150) has the molecular formula C14H20N4O2S and a molecular weight of 308.41 g/mol. Its IUPAC name is 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide.

Molecular Properties

Compound Name2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide
PubChem CID122556150
Molecular FormulaC14H20N4O2S
Molecular Weight308.41 g/mol
Exact Mass308.13
IUPAC Name2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide
SMILESCCC(NS(=O)(=O)c1ccnn1CC)c1cc(C)ccn1
InChIInChI=1S/C14H20N4O2S/c1-4-12(13-10-11(3)6-8-15-13)17-21(19,20)14-7-9-16-18(14)5-2/h6-10,12,17H,4-5H2,1-3H3
InChIKeyZLZNAABRZUQTNL-UHFFFAOYSA-N
XLogP2.04
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]propane-1-sulfonamide
CID 125438890
N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]pyrrolidine-1-sulfonamide
CID 125437950
N-[(2S)-1-aminopropan-2-yl]-2-ethylpyrazole-3-sulfonamide
CID 120713079
2-ethyl-5-methyl-N-[(1R)-1-pyridin-2-ylpropyl]pyrazole-3-sulfonamide
CID 125439319
2-ethyl-N-methylpyrazole-3-sulfonamide
CID 130637633
1-cyclopentyl-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]methanesulfonamide
CID 125443780
N-[(3,5-dimethylphenyl)methylsulfonyl]-2-ethylpyrazole-3-sulfonamide
CID 167825209
N-(1-aminohexan-2-yl)-2-ethylpyrazole-3-sulfonamide
CID 120712481
N-(3-aminobutyl)-2-ethylpyrazole-3-sulfonamide;hydrochloride
CID 120708509
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-methyl-2-pyridinyl)ethyl]hydrazine
CID 105219848
2-ethyl-N-[(2R)-2-(ethylamino)propyl]pyrazole-3-sulfonamide
CID 120713883
2-ethyl-5-methyl-N-[(1R)-1-pyridin-3-ylpropyl]pyrazole-3-sulfonamide
CID 125439730

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide?
The IUPAC name of 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide (CID 122556150) is 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide.
What is the SMILES notation for 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide?
The canonical SMILES for 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide is CCC(NS(=O)(=O)c1ccnn1CC)c1cc(C)ccn1.
What is the InChIKey of 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide?
The InChIKey is ZLZNAABRZUQTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2S/c1-4-12(13-10-11(3)6-8-15-13)17-21(19,20)14-7-9-16-18(14)5-2/h6-10,12,17H,4-5H2,1-3H3.
What are the key properties of 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide?
2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide has a molecular weight of 308.41 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazole-3-sulfonamide is sourced from PubChem (CID 122556150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).