N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine

C13H14N2O2 — CID 57394661

IUPACN-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine
SMILESC=C(CN(O)c1cc(C)on1)c1ccccc1
InChIInChI=1S/C13H14N2O2/c1-10(12-6-4-3-5-7-12)9-15(16)13-8-11(2)17-14-13/h3-8,16H,1,9H2,2H3
InChIKeyUOSMOPUNPDFHTH-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.89
Rot. Bonds4

About N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine

N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine (PubChem CID 57394661) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine
PubChem CID57394661
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine
SMILESC=C(CN(O)c1cc(C)on1)c1ccccc1
InChIInChI=1S/C13H14N2O2/c1-10(12-6-4-3-5-7-12)9-15(16)13-8-11(2)17-14-13/h3-8,16H,1,9H2,2H3
InChIKeyUOSMOPUNPDFHTH-UHFFFAOYSA-N
XLogP2.89
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.89
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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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine (CID 57394661) is N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine is C=C(CN(O)c1cc(C)on1)c1ccccc1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine?
The InChIKey is UOSMOPUNPDFHTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-10(12-6-4-3-5-7-12)9-15(16)13-8-11(2)17-14-13/h3-8,16H,1,9H2,2H3.
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine?
N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine has a molecular weight of 230.27 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-N-(2-phenylprop-2-enyl)hydroxylamine is sourced from PubChem (CID 57394661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).