N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine

C6H16NO3P — CID 541932

IUPACN-[methoxy(propoxy)phosphoryl]-N-methylmethanamine
SMILESCCCOP(=O)(OC)N(C)C
InChIInChI=1S/C6H16NO3P/c1-5-6-10-11(8,9-4)7(2)3/h5-6H2,1-4H3
InChIKeyBAUPULULEWZOMJ-UHFFFAOYSA-N
MW181.17 g/mol
LogP1.73
Rot. Bonds5

About N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine

N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine (PubChem CID 541932) has the molecular formula C6H16NO3P and a molecular weight of 181.17 g/mol. Its IUPAC name is N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[methoxy(propoxy)phosphoryl]-N-methylmethanamine
PubChem CID541932
Molecular FormulaC6H16NO3P
Molecular Weight181.17 g/mol
Exact Mass181.09
IUPAC NameN-[methoxy(propoxy)phosphoryl]-N-methylmethanamine
SMILESCCCOP(=O)(OC)N(C)C
InChIInChI=1S/C6H16NO3P/c1-5-6-10-11(8,9-4)7(2)3/h5-6H2,1-4H3
InChIKeyBAUPULULEWZOMJ-UHFFFAOYSA-N
XLogP1.73
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.17
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-dimethoxyphosphoryl-N-methylpropan-1-amine
CID 22756487
1-[dimethoxyphosphoryl(propoxy)phosphoryl]oxypropane
CID 18430553
N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine
CID 170850998
N-dipropoxyphosphoryl-N-ethylpropan-1-amine
CID 24741650
N-[ethoxy(methoxy)phosphoryl]-N-propylpropan-1-amine
CID 86037664
1-[methoxy(propyl)phosphoryl]oxypropane
CID 587089
1-[methyl(propoxy)phosphoryl]oxypropane
CID 566276
diiodo propyl phosphate
CID 175578929
N-[methoxy(propan-2-yloxy)phosphoryl]-N-methylpropan-1-amine
CID 170850992
[dibutoxyphosphoryl(hydroxymethyl)amino]methanol
CID 20528591
1-[dibutoxyphosphorylmethyl(methoxy)phosphoryl]oxybutane
CID 23044732
1-[[methoxy(propan-2-yl)phosphoryl]oxy-propan-2-ylphosphoryl]oxypropane
CID 586976

Frequently Asked Questions

What is the IUPAC name of N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine?
The IUPAC name of N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine (CID 541932) is N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine.
What is the SMILES notation for N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine?
The canonical SMILES for N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine is CCCOP(=O)(OC)N(C)C.
What is the InChIKey of N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine?
The InChIKey is BAUPULULEWZOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NO3P/c1-5-6-10-11(8,9-4)7(2)3/h5-6H2,1-4H3.
What are the key properties of N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine?
N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine has a molecular weight of 181.17 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine is sourced from PubChem (CID 541932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).