2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide

C8H7N3OS2 — CID 2743952

IUPAC2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide
SMILESNNC(=O)c1csc(-c2cccs2)n1
InChIInChI=1S/C8H7N3OS2/c9-11-7(12)5-4-14-8(10-5)6-2-1-3-13-6/h1-4H,9H2,(H,11,12)
InChIKeyUHTMEFBCYDRAQK-UHFFFAOYSA-N
MW225.30 g/mol
LogP1.48
Rot. Bonds2

About 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide

2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide (PubChem CID 2743952) has the molecular formula C8H7N3OS2 and a molecular weight of 225.30 g/mol. Its IUPAC name is 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide.

Molecular Properties

Compound Name2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide
PubChem CID2743952
Molecular FormulaC8H7N3OS2
Molecular Weight225.30 g/mol
Exact Mass225.00
IUPAC Name2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide
SMILESNNC(=O)c1csc(-c2cccs2)n1
InChIInChI=1S/C8H7N3OS2/c9-11-7(12)5-4-14-8(10-5)6-2-1-3-13-6/h1-4H,9H2,(H,11,12)
InChIKeyUHTMEFBCYDRAQK-UHFFFAOYSA-N
XLogP1.48
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 51.48
H-Bond Donors ≤ 52
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 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide?
The IUPAC name of 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide (CID 2743952) is 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide.
What is the SMILES notation for 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide?
The canonical SMILES for 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide is NNC(=O)c1csc(-c2cccs2)n1.
What is the InChIKey of 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide?
The InChIKey is UHTMEFBCYDRAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS2/c9-11-7(12)5-4-14-8(10-5)6-2-1-3-13-6/h1-4H,9H2,(H,11,12).
What are the key properties of 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide?
2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide has a molecular weight of 225.30 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide is sourced from PubChem (CID 2743952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).