N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine

C10H24NO3P — CID 14638364

IUPACN-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine
SMILESCCOP(=O)(OCC)N(C(C)C)C(C)C
InChIInChI=1S/C10H24NO3P/c1-7-13-15(12,14-8-2)11(9(3)4)10(5)6/h9-10H,7-8H2,1-6H3
InChIKeyNVDVRORLFKQMEJ-UHFFFAOYSA-N
MW237.28 g/mol
LogP3.29
Rot. Bonds7

About N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine

N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine (PubChem CID 14638364) has the molecular formula C10H24NO3P and a molecular weight of 237.28 g/mol. Its IUPAC name is N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine
PubChem CID14638364
Molecular FormulaC10H24NO3P
Molecular Weight237.28 g/mol
Exact Mass237.15
IUPAC NameN-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine
SMILESCCOP(=O)(OCC)N(C(C)C)C(C)C
InChIInChI=1S/C10H24NO3P/c1-7-13-15(12,14-8-2)11(9(3)4)10(5)6/h9-10H,7-8H2,1-6H3
InChIKeyNVDVRORLFKQMEJ-UHFFFAOYSA-N
XLogP3.29
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine (CID 14638364) is N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine is CCOP(=O)(OCC)N(C(C)C)C(C)C.
What is the InChIKey of N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine?
The InChIKey is NVDVRORLFKQMEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24NO3P/c1-7-13-15(12,14-8-2)11(9(3)4)10(5)6/h9-10H,7-8H2,1-6H3.
What are the key properties of N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine?
N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine has a molecular weight of 237.28 g/mol, XLogP of 3.29, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-diethoxyphosphoryl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 14638364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).