thiophene-3-carboxamide;hydrochloride

C5H6ClNOS — CID 67696565

IUPACthiophene-3-carboxamide;hydrochloride
SMILESCl.NC(=O)c1ccsc1
InChIInChI=1S/C5H5NOS.ClH/c6-5(7)4-1-2-8-3-4;/h1-3H,(H2,6,7);1H
InChIKeyPFLSMRPNBPVYCD-UHFFFAOYSA-N
MW163.63 g/mol
LogP1.27
Rot. Bonds1

About thiophene-3-carboxamide;hydrochloride

thiophene-3-carboxamide;hydrochloride (PubChem CID 67696565) has the molecular formula C5H6ClNOS and a molecular weight of 163.63 g/mol. Its IUPAC name is thiophene-3-carboxamide;hydrochloride.

Molecular Properties

Compound Namethiophene-3-carboxamide;hydrochloride
PubChem CID67696565
Molecular FormulaC5H6ClNOS
Molecular Weight163.63 g/mol
Exact Mass162.99
IUPAC Namethiophene-3-carboxamide;hydrochloride
SMILESCl.NC(=O)c1ccsc1
InChIInChI=1S/C5H5NOS.ClH/c6-5(7)4-1-2-8-3-4;/h1-3H,(H2,6,7);1H
InChIKeyPFLSMRPNBPVYCD-UHFFFAOYSA-N
XLogP1.27
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.63
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of thiophene-3-carboxamide;hydrochloride?
The IUPAC name of thiophene-3-carboxamide;hydrochloride (CID 67696565) is thiophene-3-carboxamide;hydrochloride.
What is the SMILES notation for thiophene-3-carboxamide;hydrochloride?
The canonical SMILES for thiophene-3-carboxamide;hydrochloride is Cl.NC(=O)c1ccsc1.
What is the InChIKey of thiophene-3-carboxamide;hydrochloride?
The InChIKey is PFLSMRPNBPVYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NOS.ClH/c6-5(7)4-1-2-8-3-4;/h1-3H,(H2,6,7);1H.
What are the key properties of thiophene-3-carboxamide;hydrochloride?
thiophene-3-carboxamide;hydrochloride has a molecular weight of 163.63 g/mol, XLogP of 1.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for thiophene-3-carboxamide;hydrochloride is sourced from PubChem (CID 67696565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).