methane;O-[(4-methoxyphenyl)methyl]hydroxylamine

C9H15NO2 — CID 142048761

IUPACmethane;O-[(4-methoxyphenyl)methyl]hydroxylamine
SMILESC.COc1ccc(CON)cc1
InChIInChI=1S/C8H11NO2.CH4/c1-10-8-4-2-7(3-5-8)6-11-9;/h2-5H,6,9H2,1H3;1H4
InChIKeyMLABJKRVYRZSIH-UHFFFAOYSA-N
MW169.22 g/mol
LogP1.72
Rot. Bonds3

About methane;O-[(4-methoxyphenyl)methyl]hydroxylamine

methane;O-[(4-methoxyphenyl)methyl]hydroxylamine (PubChem CID 142048761) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is methane;O-[(4-methoxyphenyl)methyl]hydroxylamine.

Molecular Properties

Compound Namemethane;O-[(4-methoxyphenyl)methyl]hydroxylamine
PubChem CID142048761
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Namemethane;O-[(4-methoxyphenyl)methyl]hydroxylamine
SMILESC.COc1ccc(CON)cc1
InChIInChI=1S/C8H11NO2.CH4/c1-10-8-4-2-7(3-5-8)6-11-9;/h2-5H,6,9H2,1H3;1H4
InChIKeyMLABJKRVYRZSIH-UHFFFAOYSA-N
XLogP1.72
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.72
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

(4-methoxyphenyl)methyl hypobromite
CID 166766888
1-methoxy-4-[[(E)-4-[(4-methoxyphenyl)methoxy]but-2-enoxy]methyl]benzene
CID 14814212
tetrakis[(4-methoxyphenyl)methoxy]boranuide
CID 101479355
1-methoxy-4-[4-(4-methoxyphenyl)but-2-enyl]benzene
CID 54485845
1-methoxy-4-[(2-methylpropan-2-yl)oxymethyl]benzene
CID 11206354
1-[[(E)-but-2-en-2-yl]oxymethyl]-4-methoxybenzene
CID 145479406
(4-methoxyphenyl)methyl silylformate
CID 123289214
(4-methoxyphenyl)methoxymethanethioic S-acid
CID 139442271
2-[(4-methoxyphenyl)methoxy]guanidine
CID 3601250
diaminomethylidene-[(4-methoxyphenyl)methoxy]azanium
CID 3601249
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
1-[[bis[(4-methoxyphenyl)methoxy]methoxy-[(4-methoxyphenyl)methoxy]methoxy]methyl]-4-methoxybenzene
CID 66849270

Frequently Asked Questions

What is the IUPAC name of methane;O-[(4-methoxyphenyl)methyl]hydroxylamine?
The IUPAC name of methane;O-[(4-methoxyphenyl)methyl]hydroxylamine (CID 142048761) is methane;O-[(4-methoxyphenyl)methyl]hydroxylamine.
What is the SMILES notation for methane;O-[(4-methoxyphenyl)methyl]hydroxylamine?
The canonical SMILES for methane;O-[(4-methoxyphenyl)methyl]hydroxylamine is C.COc1ccc(CON)cc1.
What is the InChIKey of methane;O-[(4-methoxyphenyl)methyl]hydroxylamine?
The InChIKey is MLABJKRVYRZSIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2.CH4/c1-10-8-4-2-7(3-5-8)6-11-9;/h2-5H,6,9H2,1H3;1H4.
What are the key properties of methane;O-[(4-methoxyphenyl)methyl]hydroxylamine?
methane;O-[(4-methoxyphenyl)methyl]hydroxylamine has a molecular weight of 169.22 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;O-[(4-methoxyphenyl)methyl]hydroxylamine is sourced from PubChem (CID 142048761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).