[aminomethyl(methoxy)phosphoryl]oxymethanamine

C3H11N2O3P — CID 174733426

IUPAC[aminomethyl(methoxy)phosphoryl]oxymethanamine
SMILESCOP(=O)(CN)OCN
InChIInChI=1S/C3H11N2O3P/c1-7-9(6,3-5)8-2-4/h2-5H2,1H3
InChIKeySGRYYKBKTMDDGK-UHFFFAOYSA-N
MW154.11 g/mol
LogP-0.33
Rot. Bonds4

About [aminomethyl(methoxy)phosphoryl]oxymethanamine

[aminomethyl(methoxy)phosphoryl]oxymethanamine (PubChem CID 174733426) has the molecular formula C3H11N2O3P and a molecular weight of 154.11 g/mol. Its IUPAC name is [aminomethyl(methoxy)phosphoryl]oxymethanamine.

Molecular Properties

Compound Name[aminomethyl(methoxy)phosphoryl]oxymethanamine
PubChem CID174733426
Molecular FormulaC3H11N2O3P
Molecular Weight154.11 g/mol
Exact Mass154.05
IUPAC Name[aminomethyl(methoxy)phosphoryl]oxymethanamine
SMILESCOP(=O)(CN)OCN
InChIInChI=1S/C3H11N2O3P/c1-7-9(6,3-5)8-2-4/h2-5H2,1H3
InChIKeySGRYYKBKTMDDGK-UHFFFAOYSA-N
XLogP-0.33
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.11
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

dimethoxyphosphorylmethanamine
CID 13310504
aminomethyl methyl phosphate
CID 123377325
methylsulfinylmethane;trimethyl phosphate
CID 161484934
1-dimethoxyphosphoryl-2-methylpropan-2-amine
CID 58928872
[aminomethyl(phosphonomethoxy)phosphoryl]oxymethylphosphonic acid
CID 54475795
2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate
CID 147848914
1-[fluoromethyl(methoxy)phosphoryl]oxyethane
CID 13426238
ethyl dihydrogen phosphate;trimethyl phosphate
CID 160912301
1-[methoxy(propyl)phosphoryl]oxypropane
CID 587089
aminomethyl 2-(methoxymethyl)butyl methyl phosphate
CID 54539586
chloromethyl dimethyl phosphate
CID 88544336
dimethoxyphosphoryl 2-aminoacetate
CID 150492348

Frequently Asked Questions

What is the IUPAC name of [aminomethyl(methoxy)phosphoryl]oxymethanamine?
The IUPAC name of [aminomethyl(methoxy)phosphoryl]oxymethanamine (CID 174733426) is [aminomethyl(methoxy)phosphoryl]oxymethanamine.
What is the SMILES notation for [aminomethyl(methoxy)phosphoryl]oxymethanamine?
The canonical SMILES for [aminomethyl(methoxy)phosphoryl]oxymethanamine is COP(=O)(CN)OCN.
What is the InChIKey of [aminomethyl(methoxy)phosphoryl]oxymethanamine?
The InChIKey is SGRYYKBKTMDDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H11N2O3P/c1-7-9(6,3-5)8-2-4/h2-5H2,1H3.
What are the key properties of [aminomethyl(methoxy)phosphoryl]oxymethanamine?
[aminomethyl(methoxy)phosphoryl]oxymethanamine has a molecular weight of 154.11 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [aminomethyl(methoxy)phosphoryl]oxymethanamine is sourced from PubChem (CID 174733426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).