N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine

C11H17NO2 — CID 82606296

IUPACN-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine
SMILESCOc1ccc(C(C)(C)N(C)O)cc1
InChIInChI=1S/C11H17NO2/c1-11(2,12(3)13)9-5-7-10(14-4)8-6-9/h5-8,13H,1-4H3
InChIKeyHHQFNLIQBZJISM-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.25
Rot. Bonds3

About N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine

N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine (PubChem CID 82606296) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine
PubChem CID82606296
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine
SMILESCOc1ccc(C(C)(C)N(C)O)cc1
InChIInChI=1S/C11H17NO2/c1-11(2,12(3)13)9-5-7-10(14-4)8-6-9/h5-8,13H,1-4H3
InChIKeyHHQFNLIQBZJISM-UHFFFAOYSA-N
XLogP2.25
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.25
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

2-(hydroxymethyl)-2-(4-methoxyphenyl)propane-1,3-diol
CID 175668445
(2S)-2-(dimethylamino)-2-(4-methoxyphenyl)propanoic acid
CID 93297247
2-methoxy-2-(4-methoxyphenyl)propan-1-ol
CID 105449931
CID 102373172
CID 102373172
1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene
CID 100982680
2-(4-methoxyphenyl)butan-2-ol
CID 10307904
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 19875161
bis[2-(4-methoxyphenyl)propan-2-yl]diazene
CID 101224810
ethane;4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 91273565
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol;tungsten
CID 158462536
1-methoxy-4-(2-methylpent-3-yn-2-yl)benzene
CID 19066508
1,4-bis[dimethoxy-(4-methoxyphenyl)methyl]benzene
CID 86224004

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine?
The IUPAC name of N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine (CID 82606296) is N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine.
What is the SMILES notation for N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine?
The canonical SMILES for N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine is COc1ccc(C(C)(C)N(C)O)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine?
The InChIKey is HHQFNLIQBZJISM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-11(2,12(3)13)9-5-7-10(14-4)8-6-9/h5-8,13H,1-4H3.
What are the key properties of N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine?
N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine has a molecular weight of 195.26 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)propan-2-yl]-N-methylhydroxylamine is sourced from PubChem (CID 82606296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).