thiophene-2-carboximidamide;hydrochloride

C5H7ClN2S — CID 2781759

IUPACthiophene-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cccs1
InChIInChI=1S/C5H6N2S.ClH/c6-5(7)4-2-1-3-8-4;/h1-3H,(H3,6,7);1H
InChIKeyURAGJMBGNVOIJC-UHFFFAOYSA-N
MW162.65 g/mol
LogP1.45
Rot. Bonds1

About thiophene-2-carboximidamide;hydrochloride

thiophene-2-carboximidamide;hydrochloride (PubChem CID 2781759) has the molecular formula C5H7ClN2S and a molecular weight of 162.65 g/mol. Its IUPAC name is thiophene-2-carboximidamide;hydrochloride.

Molecular Properties

Compound Namethiophene-2-carboximidamide;hydrochloride
PubChem CID2781759
Molecular FormulaC5H7ClN2S
Molecular Weight162.65 g/mol
Exact Mass162.00
IUPAC Namethiophene-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cccs1
InChIInChI=1S/C5H6N2S.ClH/c6-5(7)4-2-1-3-8-4;/h1-3H,(H3,6,7);1H
InChIKeyURAGJMBGNVOIJC-UHFFFAOYSA-N
XLogP1.45
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.65
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of thiophene-2-carboximidamide;hydrochloride?
The IUPAC name of thiophene-2-carboximidamide;hydrochloride (CID 2781759) is thiophene-2-carboximidamide;hydrochloride.
What is the SMILES notation for thiophene-2-carboximidamide;hydrochloride?
The canonical SMILES for thiophene-2-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1cccs1.
What is the InChIKey of thiophene-2-carboximidamide;hydrochloride?
The InChIKey is URAGJMBGNVOIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2S.ClH/c6-5(7)4-2-1-3-8-4;/h1-3H,(H3,6,7);1H.
What are the key properties of thiophene-2-carboximidamide;hydrochloride?
thiophene-2-carboximidamide;hydrochloride has a molecular weight of 162.65 g/mol, XLogP of 1.45, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for thiophene-2-carboximidamide;hydrochloride is sourced from PubChem (CID 2781759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).