N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine

C10H13NO3 — CID 83484577

IUPACN-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
SMILESONCc1cccc(OC2COC2)c1
InChIInChI=1S/C10H13NO3/c12-11-5-8-2-1-3-9(4-8)14-10-6-13-7-10/h1-4,10-12H,5-7H2
InChIKeyZKNCPJGTLOOAAF-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.94
Rot. Bonds4

About N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine

N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine (PubChem CID 83484577) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine.

Molecular Properties

Compound NameN-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
PubChem CID83484577
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC NameN-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
SMILESONCc1cccc(OC2COC2)c1
InChIInChI=1S/C10H13NO3/c12-11-5-8-2-1-3-9(4-8)14-10-6-13-7-10/h1-4,10-12H,5-7H2
InChIKeyZKNCPJGTLOOAAF-UHFFFAOYSA-N
XLogP0.94
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

O-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
CID 117285119
2-[3-(oxetan-3-yloxy)phenyl]acetonitrile
CID 84771028
N-[[3-(oxolan-3-yloxy)phenyl]methyl]ethanamine
CID 63556352
N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine
CID 117283837
3-(3-bromophenoxy)oxetane
CID 83487082
N-[[2-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
CID 83484576
N-[(3-cyclopropyloxyphenyl)methyl]cyclopropanamine
CID 114521707
N-[[3-(difluoromethoxy)phenyl]methyl]hydroxylamine
CID 117281301
3-[3-(oxolan-3-yloxy)phenyl]propan-1-ol
CID 117318293
(3-cyclopropyloxyphenyl)methanol
CID 57336629
N-methylsulfonyl-3-(oxetan-3-yloxy)benzamide
CID 122422617
3-(oxetan-3-yloxy)benzaldehyde
CID 83482101

Frequently Asked Questions

What is the IUPAC name of N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine?
The IUPAC name of N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine (CID 83484577) is N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine.
What is the SMILES notation for N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine?
The canonical SMILES for N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine is ONCc1cccc(OC2COC2)c1.
What is the InChIKey of N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine?
The InChIKey is ZKNCPJGTLOOAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c12-11-5-8-2-1-3-9(4-8)14-10-6-13-7-10/h1-4,10-12H,5-7H2.
What are the key properties of N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine?
N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine has a molecular weight of 195.22 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine is sourced from PubChem (CID 83484577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).