O-(thietan-3-yl)hydroxylamine

C3H7NOS — CID 14207367

IUPACO-(thietan-3-yl)hydroxylamine
SMILESNOC1CSC1
InChIInChI=1S/C3H7NOS/c4-5-3-1-6-2-3/h3H,1-2,4H2
InChIKeyIJCRYSFAQXTBFX-UHFFFAOYSA-N
MW105.16 g/mol
LogP-0.01
Rot. Bonds1

About O-(thietan-3-yl)hydroxylamine

O-(thietan-3-yl)hydroxylamine (PubChem CID 14207367) has the molecular formula C3H7NOS and a molecular weight of 105.16 g/mol. Its IUPAC name is O-(thietan-3-yl)hydroxylamine.

Molecular Properties

Compound NameO-(thietan-3-yl)hydroxylamine
PubChem CID14207367
Molecular FormulaC3H7NOS
Molecular Weight105.16 g/mol
Exact Mass105.02
IUPAC NameO-(thietan-3-yl)hydroxylamine
SMILESNOC1CSC1
InChIInChI=1S/C3H7NOS/c4-5-3-1-6-2-3/h3H,1-2,4H2
InChIKeyIJCRYSFAQXTBFX-UHFFFAOYSA-N
XLogP-0.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.16
LogP ≤ 5-0.01
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-(thietan-3-yl)hydroxylamine?
The IUPAC name of O-(thietan-3-yl)hydroxylamine (CID 14207367) is O-(thietan-3-yl)hydroxylamine.
What is the SMILES notation for O-(thietan-3-yl)hydroxylamine?
The canonical SMILES for O-(thietan-3-yl)hydroxylamine is NOC1CSC1.
What is the InChIKey of O-(thietan-3-yl)hydroxylamine?
The InChIKey is IJCRYSFAQXTBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NOS/c4-5-3-1-6-2-3/h3H,1-2,4H2.
What are the key properties of O-(thietan-3-yl)hydroxylamine?
O-(thietan-3-yl)hydroxylamine has a molecular weight of 105.16 g/mol, XLogP of -0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(thietan-3-yl)hydroxylamine is sourced from PubChem (CID 14207367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).