N-methyl-N-(1-phenylethyl)hydroxylamine

C9H13NO — CID 570702

IUPACN-methyl-N-(1-phenylethyl)hydroxylamine
SMILESCC(c1ccccc1)N(C)O
InChIInChI=1S/C9H13NO/c1-8(10(2)11)9-6-4-3-5-7-9/h3-8,11H,1-2H3
InChIKeyILJJPSBIKXXLRQ-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.07
Rot. Bonds2

About N-methyl-N-(1-phenylethyl)hydroxylamine

N-methyl-N-(1-phenylethyl)hydroxylamine (PubChem CID 570702) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is N-methyl-N-(1-phenylethyl)hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-(1-phenylethyl)hydroxylamine
PubChem CID570702
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC NameN-methyl-N-(1-phenylethyl)hydroxylamine
SMILESCC(c1ccccc1)N(C)O
InChIInChI=1S/C9H13NO/c1-8(10(2)11)9-6-4-3-5-7-9/h3-8,11H,1-2H3
InChIKeyILJJPSBIKXXLRQ-UHFFFAOYSA-N
XLogP2.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.07
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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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-phenylethyl)hydroxylamine?
The IUPAC name of N-methyl-N-(1-phenylethyl)hydroxylamine (CID 570702) is N-methyl-N-(1-phenylethyl)hydroxylamine.
What is the SMILES notation for N-methyl-N-(1-phenylethyl)hydroxylamine?
The canonical SMILES for N-methyl-N-(1-phenylethyl)hydroxylamine is CC(c1ccccc1)N(C)O.
What is the InChIKey of N-methyl-N-(1-phenylethyl)hydroxylamine?
The InChIKey is ILJJPSBIKXXLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-8(10(2)11)9-6-4-3-5-7-9/h3-8,11H,1-2H3.
What are the key properties of N-methyl-N-(1-phenylethyl)hydroxylamine?
N-methyl-N-(1-phenylethyl)hydroxylamine has a molecular weight of 151.21 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-phenylethyl)hydroxylamine is sourced from PubChem (CID 570702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).