1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine

C7H18NO3P — CID 167255284

IUPAC1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)CP(=O)(OC)OC
InChIInChI=1S/C7H18NO3P/c1-7(2,8-3)6-12(9,10-4)11-5/h8H,6H2,1-5H3
InChIKeyBCOOXTJRBUZUQT-UHFFFAOYSA-N
MW195.20 g/mol
LogP1.47
Rot. Bonds5

About 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine

1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine (PubChem CID 167255284) has the molecular formula C7H18NO3P and a molecular weight of 195.20 g/mol. Its IUPAC name is 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Name1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine
PubChem CID167255284
Molecular FormulaC7H18NO3P
Molecular Weight195.20 g/mol
Exact Mass195.10
IUPAC Name1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)CP(=O)(OC)OC
InChIInChI=1S/C7H18NO3P/c1-7(2,8-3)6-12(9,10-4)11-5/h8H,6H2,1-5H3
InChIKeyBCOOXTJRBUZUQT-UHFFFAOYSA-N
XLogP1.47
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine?
The IUPAC name of 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine (CID 167255284) is 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine.
What is the SMILES notation for 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine?
The canonical SMILES for 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine is CNC(C)(C)CP(=O)(OC)OC.
What is the InChIKey of 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine?
The InChIKey is BCOOXTJRBUZUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18NO3P/c1-7(2,8-3)6-12(9,10-4)11-5/h8H,6H2,1-5H3.
What are the key properties of 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine?
1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine has a molecular weight of 195.20 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dimethoxyphosphoryl-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 167255284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).