5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride

C8H7ClN2OS2 — CID 70043365

IUPAC5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride
SMILESCl.NC(=O)c1ccc(-c2nccs2)s1
InChIInChI=1S/C8H6N2OS2.ClH/c9-7(11)5-1-2-6(13-5)8-10-3-4-12-8;/h1-4H,(H2,9,11);1H
InChIKeyAOSOWUOXSAPYIA-UHFFFAOYSA-N
MW246.74 g/mol
LogP2.39
Rot. Bonds2

About 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride

5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride (PubChem CID 70043365) has the molecular formula C8H7ClN2OS2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride
PubChem CID70043365
Molecular FormulaC8H7ClN2OS2
Molecular Weight246.74 g/mol
Exact Mass245.97
IUPAC Name5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride
SMILESCl.NC(=O)c1ccc(-c2nccs2)s1
InChIInChI=1S/C8H6N2OS2.ClH/c9-7(11)5-1-2-6(13-5)8-10-3-4-12-8;/h1-4H,(H2,9,11);1H
InChIKeyAOSOWUOXSAPYIA-UHFFFAOYSA-N
XLogP2.39
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride (CID 70043365) is 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride is Cl.NC(=O)c1ccc(-c2nccs2)s1.
What is the InChIKey of 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is AOSOWUOXSAPYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2OS2.ClH/c9-7(11)5-1-2-6(13-5)8-10-3-4-12-8;/h1-4H,(H2,9,11);1H.
What are the key properties of 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride?
5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 246.74 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3-thiazol-2-yl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 70043365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).