2-[(methoxyamino)methyl]thiophen-3-amine

C6H10N2OS — CID 82707373

IUPAC2-[(methoxyamino)methyl]thiophen-3-amine
SMILESCONCc1sccc1N
InChIInChI=1S/C6H10N2OS/c1-9-8-4-6-5(7)2-3-10-6/h2-3,8H,4,7H2,1H3
InChIKeyQGDQREXXNMWZOD-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.98
Rot. Bonds3

About 2-[(methoxyamino)methyl]thiophen-3-amine

2-[(methoxyamino)methyl]thiophen-3-amine (PubChem CID 82707373) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is 2-[(methoxyamino)methyl]thiophen-3-amine.

Molecular Properties

Compound Name2-[(methoxyamino)methyl]thiophen-3-amine
PubChem CID82707373
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name2-[(methoxyamino)methyl]thiophen-3-amine
SMILESCONCc1sccc1N
InChIInChI=1S/C6H10N2OS/c1-9-8-4-6-5(7)2-3-10-6/h2-3,8H,4,7H2,1H3
InChIKeyQGDQREXXNMWZOD-UHFFFAOYSA-N
XLogP0.98
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(methoxyamino)methyl]thiophen-3-amine 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 2-[(methoxyamino)methyl]thiophen-3-amine?
The IUPAC name of 2-[(methoxyamino)methyl]thiophen-3-amine (CID 82707373) is 2-[(methoxyamino)methyl]thiophen-3-amine.
What is the SMILES notation for 2-[(methoxyamino)methyl]thiophen-3-amine?
The canonical SMILES for 2-[(methoxyamino)methyl]thiophen-3-amine is CONCc1sccc1N.
What is the InChIKey of 2-[(methoxyamino)methyl]thiophen-3-amine?
The InChIKey is QGDQREXXNMWZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-9-8-4-6-5(7)2-3-10-6/h2-3,8H,4,7H2,1H3.
What are the key properties of 2-[(methoxyamino)methyl]thiophen-3-amine?
2-[(methoxyamino)methyl]thiophen-3-amine has a molecular weight of 158.23 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(methoxyamino)methyl]thiophen-3-amine is sourced from PubChem (CID 82707373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).