O-(thiophen-2-ylmethyl)hydroxylamine

C5H7NOS — CID 15209271

IUPACO-(thiophen-2-ylmethyl)hydroxylamine
SMILESNOCc1cccs1
InChIInChI=1S/C5H7NOS/c6-7-4-5-2-1-3-8-5/h1-3H,4,6H2
InChIKeyIBRFQKKMRBKIFY-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.14
Rot. Bonds2

About O-(thiophen-2-ylmethyl)hydroxylamine

O-(thiophen-2-ylmethyl)hydroxylamine (PubChem CID 15209271) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is O-(thiophen-2-ylmethyl)hydroxylamine.

Molecular Properties

Compound NameO-(thiophen-2-ylmethyl)hydroxylamine
PubChem CID15209271
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC NameO-(thiophen-2-ylmethyl)hydroxylamine
SMILESNOCc1cccs1
InChIInChI=1S/C5H7NOS/c6-7-4-5-2-1-3-8-5/h1-3H,4,6H2
InChIKeyIBRFQKKMRBKIFY-UHFFFAOYSA-N
XLogP1.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-(thiophen-2-ylmethyl)hydroxylamine?
The IUPAC name of O-(thiophen-2-ylmethyl)hydroxylamine (CID 15209271) is O-(thiophen-2-ylmethyl)hydroxylamine.
What is the SMILES notation for O-(thiophen-2-ylmethyl)hydroxylamine?
The canonical SMILES for O-(thiophen-2-ylmethyl)hydroxylamine is NOCc1cccs1.
What is the InChIKey of O-(thiophen-2-ylmethyl)hydroxylamine?
The InChIKey is IBRFQKKMRBKIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c6-7-4-5-2-1-3-8-5/h1-3H,4,6H2.
What are the key properties of O-(thiophen-2-ylmethyl)hydroxylamine?
O-(thiophen-2-ylmethyl)hydroxylamine has a molecular weight of 129.18 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(thiophen-2-ylmethyl)hydroxylamine is sourced from PubChem (CID 15209271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).