5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide

C10H13N3O2S2 — CID 54947112

IUPAC5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCc2cn[nH]c2)s1
InChIInChI=1S/C10H13N3O2S2/c1-2-9-3-4-10(16-9)17(14,15)13-7-8-5-11-12-6-8/h3-6,13H,2,7H2,1H3,(H,11,12)
InChIKeyICEICTAGBSEGQS-UHFFFAOYSA-N
MW271.37 g/mol
LogP1.51
Rot. Bonds5

About 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide

5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide (PubChem CID 54947112) has the molecular formula C10H13N3O2S2 and a molecular weight of 271.37 g/mol. Its IUPAC name is 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide
PubChem CID54947112
Molecular FormulaC10H13N3O2S2
Molecular Weight271.37 g/mol
Exact Mass271.04
IUPAC Name5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCc2cn[nH]c2)s1
InChIInChI=1S/C10H13N3O2S2/c1-2-9-3-4-10(16-9)17(14,15)13-7-8-5-11-12-6-8/h3-6,13H,2,7H2,1H3,(H,11,12)
InChIKeyICEICTAGBSEGQS-UHFFFAOYSA-N
XLogP1.51
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]thiophene-2-sulfonamide
CID 87032101
4-ethoxy-N-(1H-pyrazol-4-ylmethyl)benzenesulfonamide
CID 54895795
4-iodo-N-(1H-pyrazol-4-ylmethyl)benzenesulfonamide
CID 54895455
5-ethyl-N-[[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]methyl]thiophene-2-sulfonamide
CID 110421228
4-(ethylamino)-N-(1H-pyrazol-4-ylmethyl)benzenesulfonamide
CID 55042991
5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide
CID 110602852
5-ethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]thiophene-2-sulfonamide
CID 110714698
3-[[(5-ethylthiophen-2-yl)sulfonylamino]methyl]benzoic acid
CID 61454207
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
4-amino-N-(1H-pyrazol-4-ylmethyl)benzenesulfonamide
CID 61126765
5-ethyl-N-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]thiophene-2-sulfonamide
CID 23603449

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide (CID 54947112) is 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCc2cn[nH]c2)s1.
What is the InChIKey of 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is ICEICTAGBSEGQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S2/c1-2-9-3-4-10(16-9)17(14,15)13-7-8-5-11-12-6-8/h3-6,13H,2,7H2,1H3,(H,11,12).
What are the key properties of 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide?
5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 271.37 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 54947112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).