N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine

C6H16NO4P — CID 12065471

IUPACN-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine
SMILESCOP(=O)(OC)C(NO)C(C)C
InChIInChI=1S/C6H16NO4P/c1-5(2)6(7-8)12(9,10-3)11-4/h5-8H,1-4H3
InChIKeyVNXZDLZJPHGELA-UHFFFAOYSA-N
MW197.17 g/mol
LogP1.43
Rot. Bonds5

About N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine

N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine (PubChem CID 12065471) has the molecular formula C6H16NO4P and a molecular weight of 197.17 g/mol. Its IUPAC name is N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine.

Molecular Properties

Compound NameN-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine
PubChem CID12065471
Molecular FormulaC6H16NO4P
Molecular Weight197.17 g/mol
Exact Mass197.08
IUPAC NameN-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine
SMILESCOP(=O)(OC)C(NO)C(C)C
InChIInChI=1S/C6H16NO4P/c1-5(2)6(7-8)12(9,10-3)11-4/h5-8H,1-4H3
InChIKeyVNXZDLZJPHGELA-UHFFFAOYSA-N
XLogP1.43
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.17
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine?
The IUPAC name of N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine (CID 12065471) is N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine.
What is the SMILES notation for N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine?
The canonical SMILES for N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine is COP(=O)(OC)C(NO)C(C)C.
What is the InChIKey of N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine?
The InChIKey is VNXZDLZJPHGELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NO4P/c1-5(2)6(7-8)12(9,10-3)11-4/h5-8H,1-4H3.
What are the key properties of N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine?
N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine has a molecular weight of 197.17 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-dimethoxyphosphoryl-2-methylpropyl)hydroxylamine is sourced from PubChem (CID 12065471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).