4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide

C8H10N4O2S2 — CID 61299387

IUPAC4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide
SMILESCn1cc(NS(=O)(=O)c2cc(N)cs2)cn1
InChIInChI=1S/C8H10N4O2S2/c1-12-4-7(3-10-12)11-16(13,14)8-2-6(9)5-15-8/h2-5,11H,9H2,1H3
InChIKeyRSMMENOWPHXMHO-UHFFFAOYSA-N
MW258.33 g/mol
LogP0.86
Rot. Bonds3

About 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide

4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide (PubChem CID 61299387) has the molecular formula C8H10N4O2S2 and a molecular weight of 258.33 g/mol. Its IUPAC name is 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide
PubChem CID61299387
Molecular FormulaC8H10N4O2S2
Molecular Weight258.33 g/mol
Exact Mass258.02
IUPAC Name4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide
SMILESCn1cc(NS(=O)(=O)c2cc(N)cs2)cn1
InChIInChI=1S/C8H10N4O2S2/c1-12-4-7(3-10-12)11-16(13,14)8-2-6(9)5-15-8/h2-5,11H,9H2,1H3
InChIKeyRSMMENOWPHXMHO-UHFFFAOYSA-N
XLogP0.86
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.33
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide (CID 61299387) is 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide is Cn1cc(NS(=O)(=O)c2cc(N)cs2)cn1.
What is the InChIKey of 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide?
The InChIKey is RSMMENOWPHXMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2S2/c1-12-4-7(3-10-12)11-16(13,14)8-2-6(9)5-15-8/h2-5,11H,9H2,1H3.
What are the key properties of 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide?
4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide has a molecular weight of 258.33 g/mol, XLogP of 0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-methylpyrazol-4-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 61299387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).