N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine

C15H17NO — CID 15778138

IUPACN-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine
SMILESC[C@H](c1ccccc1)N(O)Cc1ccccc1
InChIInChI=1S/C15H17NO/c1-13(15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13,17H,12H2,1H3/t13-/m1/s1
InChIKeySDWSLBSVDOPUBR-CYBMUJFWSA-N
MW227.31 g/mol
LogP3.64
Rot. Bonds4

About N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine

N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine (PubChem CID 15778138) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine.

Molecular Properties

Compound NameN-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine
PubChem CID15778138
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC NameN-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine
SMILESC[C@H](c1ccccc1)N(O)Cc1ccccc1
InChIInChI=1S/C15H17NO/c1-13(15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13,17H,12H2,1H3/t13-/m1/s1
InChIKeySDWSLBSVDOPUBR-CYBMUJFWSA-N
XLogP3.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1S)-N-benzyl-N-methyl-1-phenylethanamine
CID 122522292
1-benzyl-1-[(1S)-1-phenylethyl]hydrazine
CID 101079144
N-benzyl-2,2-dimethyl-N-[(1S)-1-phenylethyl]propanamide
CID 126749944
1-[benzyl(hydroxy)amino]-4-methyl-1-phenylpentan-2-ol
CID 101185261
(4R)-4-[benzyl-[(1S)-1-phenylethyl]amino]-2-methyl-4-phenylbutan-2-ol
CID 11559802
N-benzyl-2-phenyl-N-(1-phenylethyl)acetamide
CID 86229489
N-benzyl-N-[(1S)-1-(2,2-dimethyl-1,3-dioxol-4-yl)ethyl]hydroxylamine
CID 141372751
3-[benzyl(1-phenylethyl)amino]butanoic acid
CID 19790414
(2R)-2-[benzyl-[(1R)-1-phenylethyl]amino]propanal
CID 101191721
(1S,2S)-2-(dibenzylamino)-1-phenylpropan-1-ol
CID 11484349
(2R)-2-[benzyl-[(1R)-1-phenylethyl]amino]-2-phenylacetaldehyde
CID 101191724
N-benzyl-N-(1-diphenylphosphorylbutyl)hydroxylamine
CID 175479837

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine?
The IUPAC name of N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine (CID 15778138) is N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine.
What is the SMILES notation for N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine?
The canonical SMILES for N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine is C[C@H](c1ccccc1)N(O)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine?
The InChIKey is SDWSLBSVDOPUBR-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H17NO/c1-13(15-10-6-3-7-11-15)16(17)12-14-8-4-2-5-9-14/h2-11,13,17H,12H2,1H3/t13-/m1/s1.
What are the key properties of N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine?
N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine has a molecular weight of 227.31 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(1R)-1-phenylethyl]hydroxylamine is sourced from PubChem (CID 15778138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).