N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine

C10H15NO3 — CID 117287000

IUPACN-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine
SMILESCCOc1cc(OC)ccc1CNO
InChIInChI=1S/C10H15NO3/c1-3-14-10-6-9(13-2)5-4-8(10)7-11-12/h4-6,11-12H,3,7H2,1-2H3
InChIKeySUVTTXMOCAFZCY-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.57
Rot. Bonds5

About N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine

N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine (PubChem CID 117287000) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameN-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine
PubChem CID117287000
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC NameN-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine
SMILESCCOc1cc(OC)ccc1CNO
InChIInChI=1S/C10H15NO3/c1-3-14-10-6-9(13-2)5-4-8(10)7-11-12/h4-6,11-12H,3,7H2,1-2H3
InChIKeySUVTTXMOCAFZCY-UHFFFAOYSA-N
XLogP1.57
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.57
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

(2-ethoxy-4-methoxyphenyl)methanol
CID 61267380
N-[(2,4-diethoxyphenyl)methyl]ethanamine
CID 54804724
1-(2-ethoxy-5-methoxyphenyl)-N-methylmethanamine
CID 43276259
N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide
CID 46590246
N-[[2-(3-fluoropropoxy)-4-methoxyphenyl]methyl]ethanamine
CID 81107388
N-[[2-(ethoxymethoxy)-4-methoxyphenyl]methyl]propan-1-amine
CID 65369345
2-(2,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)acetamide
CID 9400826
1-[2-(ethylaminomethyl)-5-methoxyphenoxy]-2-methylbutan-2-ol
CID 114491840
N-[[2-(3-chloroprop-2-enoxy)-4-methoxyphenyl]methyl]ethanamine
CID 61269264
N-[(2-ethoxy-5-methoxyphenyl)methyl]propan-2-amine
CID 43276423
2-[(2-ethoxy-5-methoxyphenyl)methylamino]ethanol
CID 97179200
N-[(4-methoxy-2-propoxyphenyl)methyl]propan-2-amine
CID 61267266

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine?
The IUPAC name of N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine (CID 117287000) is N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine.
What is the SMILES notation for N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine?
The canonical SMILES for N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine is CCOc1cc(OC)ccc1CNO.
What is the InChIKey of N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine?
The InChIKey is SUVTTXMOCAFZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-3-14-10-6-9(13-2)5-4-8(10)7-11-12/h4-6,11-12H,3,7H2,1-2H3.
What are the key properties of N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine?
N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine has a molecular weight of 197.23 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-4-methoxyphenyl)methyl]hydroxylamine is sourced from PubChem (CID 117287000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).