5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide

C8H8ClN3O2S2 — CID 103100304

IUPAC5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)Nc2ccn[nH]2)sc1Cl
InChIInChI=1S/C8H8ClN3O2S2/c1-5-4-7(15-8(5)9)16(13,14)12-6-2-3-10-11-6/h2-4H,1H3,(H2,10,11,12)
InChIKeyIYTBTSGKIOPBAU-UHFFFAOYSA-N
MW277.76 g/mol
LogP2.23
Rot. Bonds3

About 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide

5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide (PubChem CID 103100304) has the molecular formula C8H8ClN3O2S2 and a molecular weight of 277.76 g/mol. Its IUPAC name is 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
PubChem CID103100304
Molecular FormulaC8H8ClN3O2S2
Molecular Weight277.76 g/mol
Exact Mass276.97
IUPAC Name5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)Nc2ccn[nH]2)sc1Cl
InChIInChI=1S/C8H8ClN3O2S2/c1-5-4-7(15-8(5)9)16(13,14)12-6-2-3-10-11-6/h2-4H,1H3,(H2,10,11,12)
InChIKeyIYTBTSGKIOPBAU-UHFFFAOYSA-N
XLogP2.23
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.76
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
CID 79989224
N-(4-bromo-2-pyridinyl)-5-chloro-4-methylthiophene-2-sulfonamide
CID 103100106
N-(4-aminophenyl)-5-chloro-4-methylthiophene-2-sulfonamide
CID 103099477
5-chloro-4-methyl-N-(5-methyl-1,2-oxazol-4-yl)thiophene-2-sulfonamide
CID 91651936
5-chloro-N-(4-cyano-5-methyl-1H-pyrazol-3-yl)-4-methylthiophene-2-sulfonamide
CID 91651974
4-[(5-chloro-4-methylthiophen-2-yl)sulfonylamino]-2-methylbenzoic acid
CID 103099684
4-chloro-2-[(5-chloro-4-methylthiophen-2-yl)sulfonylamino]benzoic acid
CID 103099599
5-chloro-N-(6-chloropyrazin-2-yl)-4-methylthiophene-2-sulfonamide
CID 103100875
N-(3-aminophenyl)-5-chloro-4-methylthiophene-2-sulfonamide
CID 103099480
N-(5-acetyl-2-pyridinyl)-5-chloro-4-methylthiophene-2-sulfonamide
CID 91662469
4-bromo-2,6-dichloro-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61394406
4-amino-2,6-dichloro-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61393048

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide (CID 103100304) is 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide is Cc1cc(S(=O)(=O)Nc2ccn[nH]2)sc1Cl.
What is the InChIKey of 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide?
The InChIKey is IYTBTSGKIOPBAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3O2S2/c1-5-4-7(15-8(5)9)16(13,14)12-6-2-3-10-11-6/h2-4H,1H3,(H2,10,11,12).
What are the key properties of 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide?
5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide has a molecular weight of 277.76 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-methyl-N-(1H-pyrazol-5-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 103100304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).