O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine

C11H12N2O2 — CID 117292521

IUPACO-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine
SMILESCc1coc(-c2ccc(CON)cc2)n1
InChIInChI=1S/C11H12N2O2/c1-8-6-14-11(13-8)10-4-2-9(3-5-10)7-15-12/h2-6H,7,12H2,1H3
InChIKeyAOLFGIJQXFKOFO-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.04
Rot. Bonds3

About O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine

O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine (PubChem CID 117292521) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine.

Molecular Properties

Compound NameO-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine
PubChem CID117292521
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC NameO-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine
SMILESCc1coc(-c2ccc(CON)cc2)n1
InChIInChI=1S/C11H12N2O2/c1-8-6-14-11(13-8)10-4-2-9(3-5-10)7-15-12/h2-6H,7,12H2,1H3
InChIKeyAOLFGIJQXFKOFO-UHFFFAOYSA-N
XLogP2.04
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]cyclopropan-1-ol
CID 117330636
4-methyl-2-[4-(piperidin-4-ylmethyl)phenyl]-1,3-oxazole
CID 117394498
2-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]propan-2-ol
CID 84682769
4-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]-1,2-oxazol-5-amine
CID 117354707
1-[1-[4-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopropyl]ethanamine
CID 117358112
4-methyl-2-(4-piperazin-1-ylphenyl)-1,3-oxazole
CID 82478157
methane;O-[(4-methoxyphenyl)methyl]hydroxylamine
CID 142048761
2-[2-(4-methyl-1,3-oxazol-2-yl)phenyl]ethanamine
CID 115022622
2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanamine
CID 25324136
(2-phenyl-1,3-oxazol-4-yl)methyl 3-methyl-1,2-oxazole-5-carboxylate
CID 18199699
2-[2-hydroxy-4-(4-methyl-1,3-oxazol-2-yl)phenyl]acetonitrile
CID 142250607
4-(bromomethyl)-2-(4-methylphenyl)-1,3-oxazole
CID 79021813

Frequently Asked Questions

What is the IUPAC name of O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine?
The IUPAC name of O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine (CID 117292521) is O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine.
What is the SMILES notation for O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine?
The canonical SMILES for O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine is Cc1coc(-c2ccc(CON)cc2)n1.
What is the InChIKey of O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine?
The InChIKey is AOLFGIJQXFKOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-8-6-14-11(13-8)10-4-2-9(3-5-10)7-15-12/h2-6H,7,12H2,1H3.
What are the key properties of O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine?
O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine has a molecular weight of 204.23 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]hydroxylamine is sourced from PubChem (CID 117292521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).