5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide

C5H6ClN3O3S2 — CID 11807266

IUPAC5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide
SMILESNNC(=O)c1cc(Cl)sc1S(N)(=O)=O
InChIInChI=1S/C5H6ClN3O3S2/c6-3-1-2(4(10)9-7)5(13-3)14(8,11)12/h1H,7H2,(H,9,10)(H2,8,11,12)
InChIKeyJEWFHMQFACQOEH-UHFFFAOYSA-N
MW255.71 g/mol
LogP-0.35
Rot. Bonds2

About 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide

5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide (PubChem CID 11807266) has the molecular formula C5H6ClN3O3S2 and a molecular weight of 255.71 g/mol. Its IUPAC name is 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide
PubChem CID11807266
Molecular FormulaC5H6ClN3O3S2
Molecular Weight255.71 g/mol
Exact Mass254.95
IUPAC Name5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide
SMILESNNC(=O)c1cc(Cl)sc1S(N)(=O)=O
InChIInChI=1S/C5H6ClN3O3S2/c6-3-1-2(4(10)9-7)5(13-3)14(8,11)12/h1H,7H2,(H,9,10)(H2,8,11,12)
InChIKeyJEWFHMQFACQOEH-UHFFFAOYSA-N
XLogP-0.35
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.71
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide (CID 11807266) is 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide is NNC(=O)c1cc(Cl)sc1S(N)(=O)=O.
What is the InChIKey of 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide?
The InChIKey is JEWFHMQFACQOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClN3O3S2/c6-3-1-2(4(10)9-7)5(13-3)14(8,11)12/h1H,7H2,(H,9,10)(H2,8,11,12).
What are the key properties of 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide?
5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide has a molecular weight of 255.71 g/mol, XLogP of -0.35, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(hydrazinecarbonyl)thiophene-2-sulfonamide is sourced from PubChem (CID 11807266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).