3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide

C10H19N3O2S — CID 62410448

IUPAC3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide
SMILESCCc1cc(S(N)(=O)=O)n(C(CC)CC)n1
InChIInChI=1S/C10H19N3O2S/c1-4-8-7-10(16(11,14)15)13(12-8)9(5-2)6-3/h7,9H,4-6H2,1-3H3,(H2,11,14,15)
InChIKeyPSPAIKQXUMMGTI-UHFFFAOYSA-N
MW245.35 g/mol
LogP1.45
Rot. Bonds5

About 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide

3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide (PubChem CID 62410448) has the molecular formula C10H19N3O2S and a molecular weight of 245.35 g/mol. Its IUPAC name is 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide.

Molecular Properties

Compound Name3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide
PubChem CID62410448
Molecular FormulaC10H19N3O2S
Molecular Weight245.35 g/mol
Exact Mass245.12
IUPAC Name3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide
SMILESCCc1cc(S(N)(=O)=O)n(C(CC)CC)n1
InChIInChI=1S/C10H19N3O2S/c1-4-8-7-10(16(11,14)15)13(12-8)9(5-2)6-3/h7,9H,4-6H2,1-3H3,(H2,11,14,15)
InChIKeyPSPAIKQXUMMGTI-UHFFFAOYSA-N
XLogP1.45
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(methoxymethyl)-1-propan-2-ylpyrazole-5-sulfonamide
CID 62407958
3-ethyl-5-methyl-1-propan-2-ylpyrazole
CID 58977189
1-tert-butyl-3-propylpyrazole-5-sulfonamide
CID 62408137
1-butyl-3-propan-2-ylpyrazole-5-sulfonamide
CID 62410069
2-[(1,3-diethylpyrazol-5-yl)methylsulfonyl]propan-1-amine
CID 81188101
5-chloro-3-ethyl-1-propan-2-ylpyrazole
CID 66020774
5-bromo-3-ethyl-1-propan-2-ylpyrazole
CID 130115872
methyl (2S)-2-(3,5-diethylpyrazol-1-yl)propanoate
CID 107427779
5-chloro-3-ethyl-1-(2-methylsulfonylethyl)pyrazole
CID 66015518
2-(2-aminoethyl)-4-bromo-6-ethylpyridazin-3-one
CID 84705568
(2R)-2-(3,5-diethylpyrazol-1-yl)propanoic acid
CID 107427777
2-(3,5-diethylpyrazol-1-yl)-N'-hydroxybutanimidamide
CID 82695392

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide?
The IUPAC name of 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide (CID 62410448) is 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide.
What is the SMILES notation for 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide?
The canonical SMILES for 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide is CCc1cc(S(N)(=O)=O)n(C(CC)CC)n1.
What is the InChIKey of 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide?
The InChIKey is PSPAIKQXUMMGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2S/c1-4-8-7-10(16(11,14)15)13(12-8)9(5-2)6-3/h7,9H,4-6H2,1-3H3,(H2,11,14,15).
What are the key properties of 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide?
3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide has a molecular weight of 245.35 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-pentan-3-ylpyrazole-5-sulfonamide is sourced from PubChem (CID 62410448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).