N-benzyl-N-(3-ethoxyphenyl)hydroxylamine

C15H17NO2 — CID 134890308

IUPACN-benzyl-N-(3-ethoxyphenyl)hydroxylamine
SMILESCCOc1cccc(N(O)Cc2ccccc2)c1
InChIInChI=1S/C15H17NO2/c1-2-18-15-10-6-9-14(11-15)16(17)12-13-7-4-3-5-8-13/h3-11,17H,2,12H2,1H3
InChIKeySLEVNBYBAJUYPL-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.48
Rot. Bonds5

About N-benzyl-N-(3-ethoxyphenyl)hydroxylamine

N-benzyl-N-(3-ethoxyphenyl)hydroxylamine (PubChem CID 134890308) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-benzyl-N-(3-ethoxyphenyl)hydroxylamine.

Molecular Properties

Compound NameN-benzyl-N-(3-ethoxyphenyl)hydroxylamine
PubChem CID134890308
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-benzyl-N-(3-ethoxyphenyl)hydroxylamine
SMILESCCOc1cccc(N(O)Cc2ccccc2)c1
InChIInChI=1S/C15H17NO2/c1-2-18-15-10-6-9-14(11-15)16(17)12-13-7-4-3-5-8-13/h3-11,17H,2,12H2,1H3
InChIKeySLEVNBYBAJUYPL-UHFFFAOYSA-N
XLogP3.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.48
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

3-ethoxy-N,N-bis(3-ethoxyphenyl)aniline
CID 70603517
N-benzyl-N-phenylhydroxylamine
CID 10241871
2-[N-[(3-ethoxyphenyl)methyl]anilino]acetic acid
CID 39385265
N-benzyl-2-(3-ethoxyphenoxy)-N-ethylacetamide
CID 112977716
N-benzyl-3-(3-ethoxyphenoxy)-N-methylpropan-1-amine
CID 2182253
3-(3-ethoxyphenyl)-N,N-dimethylpropan-1-amine
CID 170865322
2-[3-[benzenesulfonyl(benzyl)amino]phenoxy]acetic acid
CID 54481093
N-benzyl-2-(3-ethoxyanilino)-N-methylacetamide
CID 54824566
2-[(3-ethoxyphenyl)methyl-methylamino]-1-phenylethanone
CID 71497144
2-[(3-ethoxyphenyl)methylamino]-2-phenylpropan-1-ol
CID 115630491
2-[(3-ethoxyphenyl)methyl-(2-phenylethyl)amino]acetic acid
CID 39453886
N-benzyl-2-(3-methylphenoxy)-N-phenylacetamide
CID 112977258

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(3-ethoxyphenyl)hydroxylamine?
The IUPAC name of N-benzyl-N-(3-ethoxyphenyl)hydroxylamine (CID 134890308) is N-benzyl-N-(3-ethoxyphenyl)hydroxylamine.
What is the SMILES notation for N-benzyl-N-(3-ethoxyphenyl)hydroxylamine?
The canonical SMILES for N-benzyl-N-(3-ethoxyphenyl)hydroxylamine is CCOc1cccc(N(O)Cc2ccccc2)c1.
What is the InChIKey of N-benzyl-N-(3-ethoxyphenyl)hydroxylamine?
The InChIKey is SLEVNBYBAJUYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-2-18-15-10-6-9-14(11-15)16(17)12-13-7-4-3-5-8-13/h3-11,17H,2,12H2,1H3.
What are the key properties of N-benzyl-N-(3-ethoxyphenyl)hydroxylamine?
N-benzyl-N-(3-ethoxyphenyl)hydroxylamine has a molecular weight of 243.31 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(3-ethoxyphenyl)hydroxylamine is sourced from PubChem (CID 134890308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).