O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine

C12H19NO2 — CID 117299206

IUPACO-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine
SMILESCOc1c(C(C)C)ccc(C)c1CON
InChIInChI=1S/C12H19NO2/c1-8(2)10-6-5-9(3)11(7-15-13)12(10)14-4/h5-6,8H,7,13H2,1-4H3
InChIKeyAMMBPMWVXOYUGX-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.52
Rot. Bonds4

About O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine

O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine (PubChem CID 117299206) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine
PubChem CID117299206
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC NameO-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine
SMILESCOc1c(C(C)C)ccc(C)c1CON
InChIInChI=1S/C12H19NO2/c1-8(2)10-6-5-9(3)11(7-15-13)12(10)14-4/h5-6,8H,7,13H2,1-4H3
InChIKeyAMMBPMWVXOYUGX-UHFFFAOYSA-N
XLogP2.52
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.52
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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Related Compounds

O-[(5-chloro-2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine
CID 117361513
O-[2-[2-methoxy-3,6-di(propan-2-yl)phenyl]ethyl]hydroxylamine
CID 117382145
O-[[3-(1,1-difluoroethyl)-2-methoxy-6-methylphenyl]methyl]hydroxylamine
CID 117333821
1-[2-methoxy-3,6-di(propan-2-yl)phenyl]propan-2-one
CID 117374493
1-[2-methoxy-3,6-di(propan-2-yl)phenyl]propan-2-ol
CID 117379906
2-(3-methoxy-4-methyl-2-propan-2-ylphenyl)propan-1-amine
CID 117317005
[1-(2-methoxy-6-methyl-3-propan-2-ylphenyl)cyclobutyl]methanamine
CID 117371901
2-amino-3-(2-methoxy-3-methyl-6-propan-2-ylphenyl)propanoic acid
CID 117381633
2-amino-1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)ethanol
CID 84688656
2-[3-(difluoromethyl)-2-methoxy-6-methylphenyl]acetonitrile
CID 84781471
[1-(2-methoxy-3-methyl-6-propan-2-ylphenyl)cyclohexyl]methanamine
CID 117441153
2-(2-methoxy-3-propan-2-ylphenyl)propan-1-amine
CID 117296766

Frequently Asked Questions

What is the IUPAC name of O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine?
The IUPAC name of O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine (CID 117299206) is O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine?
The canonical SMILES for O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine is COc1c(C(C)C)ccc(C)c1CON.
What is the InChIKey of O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine?
The InChIKey is AMMBPMWVXOYUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-8(2)10-6-5-9(3)11(7-15-13)12(10)14-4/h5-6,8H,7,13H2,1-4H3.
What are the key properties of O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine?
O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine has a molecular weight of 209.29 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(2-methoxy-6-methyl-3-propan-2-ylphenyl)methyl]hydroxylamine is sourced from PubChem (CID 117299206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).