O-(2-thiophen-3-ylethyl)hydroxylamine

C6H9NOS — CID 11147791

IUPACO-(2-thiophen-3-ylethyl)hydroxylamine
SMILESNOCCc1ccsc1
InChIInChI=1S/C6H9NOS/c7-8-3-1-6-2-4-9-5-6/h2,4-5H,1,3,7H2
InChIKeyPCTOOBAVKKAKAB-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.18
Rot. Bonds3

About O-(2-thiophen-3-ylethyl)hydroxylamine

O-(2-thiophen-3-ylethyl)hydroxylamine (PubChem CID 11147791) has the molecular formula C6H9NOS and a molecular weight of 143.21 g/mol. Its IUPAC name is O-(2-thiophen-3-ylethyl)hydroxylamine.

Molecular Properties

Compound NameO-(2-thiophen-3-ylethyl)hydroxylamine
PubChem CID11147791
Molecular FormulaC6H9NOS
Molecular Weight143.21 g/mol
Exact Mass143.04
IUPAC NameO-(2-thiophen-3-ylethyl)hydroxylamine
SMILESNOCCc1ccsc1
InChIInChI=1S/C6H9NOS/c7-8-3-1-6-2-4-9-5-6/h2,4-5H,1,3,7H2
InChIKeyPCTOOBAVKKAKAB-UHFFFAOYSA-N
XLogP1.18
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze O-(2-thiophen-3-ylethyl)hydroxylamine 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 O-(2-thiophen-3-ylethyl)hydroxylamine?
The IUPAC name of O-(2-thiophen-3-ylethyl)hydroxylamine (CID 11147791) is O-(2-thiophen-3-ylethyl)hydroxylamine.
What is the SMILES notation for O-(2-thiophen-3-ylethyl)hydroxylamine?
The canonical SMILES for O-(2-thiophen-3-ylethyl)hydroxylamine is NOCCc1ccsc1.
What is the InChIKey of O-(2-thiophen-3-ylethyl)hydroxylamine?
The InChIKey is PCTOOBAVKKAKAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NOS/c7-8-3-1-6-2-4-9-5-6/h2,4-5H,1,3,7H2.
What are the key properties of O-(2-thiophen-3-ylethyl)hydroxylamine?
O-(2-thiophen-3-ylethyl)hydroxylamine has a molecular weight of 143.21 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-thiophen-3-ylethyl)hydroxylamine is sourced from PubChem (CID 11147791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).