N'-hydroxythiophene-2-carboximidamide

C5H6N2OS — CID 2760620

IUPACN'-hydroxythiophene-2-carboximidamide
SMILESNC(=NO)c1cccs1
InChIInChI=1S/C5H6N2OS/c6-5(7-8)4-2-1-3-9-4/h1-3,8H,(H2,6,7)
InChIKeyNKMNPRXPUZINOM-UHFFFAOYSA-N
MW142.18 g/mol
LogP0.84
Rot. Bonds1

About N'-hydroxythiophene-2-carboximidamide

N'-hydroxythiophene-2-carboximidamide (PubChem CID 2760620) has the molecular formula C5H6N2OS and a molecular weight of 142.18 g/mol. Its IUPAC name is N'-hydroxythiophene-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxythiophene-2-carboximidamide
PubChem CID2760620
Molecular FormulaC5H6N2OS
Molecular Weight142.18 g/mol
Exact Mass142.02
IUPAC NameN'-hydroxythiophene-2-carboximidamide
SMILESNC(=NO)c1cccs1
InChIInChI=1S/C5H6N2OS/c6-5(7-8)4-2-1-3-9-4/h1-3,8H,(H2,6,7)
InChIKeyNKMNPRXPUZINOM-UHFFFAOYSA-N
XLogP0.84
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxythiophene-2-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-hydroxythiophene-2-carboximidamide?
The IUPAC name of N'-hydroxythiophene-2-carboximidamide (CID 2760620) is N'-hydroxythiophene-2-carboximidamide.
What is the SMILES notation for N'-hydroxythiophene-2-carboximidamide?
The canonical SMILES for N'-hydroxythiophene-2-carboximidamide is NC(=NO)c1cccs1.
What is the InChIKey of N'-hydroxythiophene-2-carboximidamide?
The InChIKey is NKMNPRXPUZINOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2OS/c6-5(7-8)4-2-1-3-9-4/h1-3,8H,(H2,6,7).
What are the key properties of N'-hydroxythiophene-2-carboximidamide?
N'-hydroxythiophene-2-carboximidamide has a molecular weight of 142.18 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxythiophene-2-carboximidamide is sourced from PubChem (CID 2760620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).