O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine

C10H15NO2 — CID 83482464

IUPACO-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine
SMILESCOc1cc(C)c(C)cc1CON
InChIInChI=1S/C10H15NO2/c1-7-4-9(6-13-11)10(12-3)5-8(7)2/h4-5H,6,11H2,1-3H3
InChIKeyJXGLMSOWOASFOB-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.70
Rot. Bonds3

About O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine

O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine (PubChem CID 83482464) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine
PubChem CID83482464
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameO-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine
SMILESCOc1cc(C)c(C)cc1CON
InChIInChI=1S/C10H15NO2/c1-7-4-9(6-13-11)10(12-3)5-8(7)2/h4-5H,6,11H2,1-3H3
InChIKeyJXGLMSOWOASFOB-UHFFFAOYSA-N
XLogP1.70
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.70
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-[(4-methoxy-2,3,5-trimethylphenyl)methyl]hydroxylamine
CID 83698804
O-[[4-(2-fluoropropan-2-yl)-2,5-dimethoxyphenyl]methyl]hydroxylamine
CID 117359887
O-[(3-chloro-2,4-dimethoxy-5-methylphenyl)methyl]hydroxylamine
CID 117335488
O-[(5-chloro-2-methoxy-3-methylphenyl)methyl]hydroxylamine
CID 83700383
O-[[2-methoxy-5-(methoxymethyl)phenyl]methyl]hydroxylamine
CID 117286953
O-[(2-methoxy-5-methylsulfanylphenyl)methyl]hydroxylamine
CID 117288802
1-(2-chloroethyl)-2-methoxy-4,5-dimethylbenzene
CID 82469330
O-[(4-methoxy-2-methylphenyl)methyl]hydroxylamine
CID 117276532
O-[(2-methoxy-4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methyl]hydroxylamine
CID 117316718
O-[2-(4-fluoro-2-methoxy-5-methylphenyl)ethyl]hydroxylamine
CID 117288455
O-[[2-methoxy-4-(trifluoromethyl)phenyl]methyl]hydroxylamine
CID 117315137
2-(aminooxymethyl)-6-methoxy-4-propan-2-ylphenol
CID 117301823

Frequently Asked Questions

What is the IUPAC name of O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine?
The IUPAC name of O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine (CID 83482464) is O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine?
The canonical SMILES for O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine is COc1cc(C)c(C)cc1CON.
What is the InChIKey of O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine?
The InChIKey is JXGLMSOWOASFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-7-4-9(6-13-11)10(12-3)5-8(7)2/h4-5H,6,11H2,1-3H3.
What are the key properties of O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine?
O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine has a molecular weight of 181.23 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(2-methoxy-4,5-dimethylphenyl)methyl]hydroxylamine is sourced from PubChem (CID 83482464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).