5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide

C15H15N3O2S2 — CID 110732438

IUPAC5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(-c3ccn[nH]3)cc2)s1
InChIInChI=1S/C15H15N3O2S2/c1-2-13-7-8-15(21-13)22(19,20)18-12-5-3-11(4-6-12)14-9-10-16-17-14/h3-10,18H,2H2,1H3,(H,16,17)
InChIKeyLSCDNJSWHQQWDQ-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.50
Rot. Bonds5

About 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide

5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide (PubChem CID 110732438) has the molecular formula C15H15N3O2S2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide
PubChem CID110732438
Molecular FormulaC15H15N3O2S2
Molecular Weight333.44 g/mol
Exact Mass333.06
IUPAC Name5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(-c3ccn[nH]3)cc2)s1
InChIInChI=1S/C15H15N3O2S2/c1-2-13-7-8-15(21-13)22(19,20)18-12-5-3-11(4-6-12)14-9-10-16-17-14/h3-10,18H,2H2,1H3,(H,16,17)
InChIKeyLSCDNJSWHQQWDQ-UHFFFAOYSA-N
XLogP3.50
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
2-chloro-N-[4-(1H-pyrazol-5-yl)phenyl]-1,3-thiazole-5-sulfonamide
CID 61047553
5-ethyl-N-(4-methoxyphenyl)thiophene-2-sulfonamide
CID 47309103
N-(4-cyanophenyl)-5-ethylthiophene-2-sulfonamide
CID 47309319
N-(3,4-dimethylphenyl)-5-ethylthiophene-2-sulfonamide
CID 47308966
5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 61454703
5-ethyl-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 75517993
N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
CID 113231899
N-(3,5-dimethylphenyl)-5-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
CID 53083829
5-ethyl-N-imidazo[1,2-a]pyridin-6-ylthiophene-2-sulfonamide
CID 110734784
N-(3,5-dichlorophenyl)-5-ethylthiophene-2-sulfonamide
CID 113098917
N-(4-amino-3-methylphenyl)-5-ethylthiophene-2-sulfonamide
CID 54984022

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide (CID 110732438) is 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(-c3ccn[nH]3)cc2)s1.
What is the InChIKey of 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide?
The InChIKey is LSCDNJSWHQQWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S2/c1-2-13-7-8-15(21-13)22(19,20)18-12-5-3-11(4-6-12)14-9-10-16-17-14/h3-10,18H,2H2,1H3,(H,16,17).
What are the key properties of 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide?
5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide has a molecular weight of 333.44 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 110732438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).