O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine

C6H13NO2 — CID 139295039

IUPACO-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine
SMILESC[C@@H]1CCC[C@H](ON)O1
InChIInChI=1S/C6H13NO2/c1-5-3-2-4-6(8-5)9-7/h5-6H,2-4,7H2,1H3/t5-,6+/m1/s1
InChIKeyGIQLPGCRAZLOMG-RITPCOANSA-N
MW131.17 g/mol
LogP0.79
Rot. Bonds1

About O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine

O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine (PubChem CID 139295039) has the molecular formula C6H13NO2 and a molecular weight of 131.17 g/mol. Its IUPAC name is O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine.

Molecular Properties

Compound NameO-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine
PubChem CID139295039
Molecular FormulaC6H13NO2
Molecular Weight131.17 g/mol
Exact Mass131.09
IUPAC NameO-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine
SMILESC[C@@H]1CCC[C@H](ON)O1
InChIInChI=1S/C6H13NO2/c1-5-3-2-4-6(8-5)9-7/h5-6H,2-4,7H2,1H3/t5-,6+/m1/s1
InChIKeyGIQLPGCRAZLOMG-RITPCOANSA-N
XLogP0.79
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 50.79
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-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine?
The IUPAC name of O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine (CID 139295039) is O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine.
What is the SMILES notation for O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine?
The canonical SMILES for O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine is C[C@@H]1CCC[C@H](ON)O1.
What is the InChIKey of O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine?
The InChIKey is GIQLPGCRAZLOMG-RITPCOANSA-N. The full InChI is InChI=1S/C6H13NO2/c1-5-3-2-4-6(8-5)9-7/h5-6H,2-4,7H2,1H3/t5-,6+/m1/s1.
What are the key properties of O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine?
O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine has a molecular weight of 131.17 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(2S,6R)-6-methyloxan-2-yl]hydroxylamine is sourced from PubChem (CID 139295039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).