N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine

C8H20NOP — CID 16697629

IUPACN-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine
SMILESCCOPN(C(C)C)C(C)C
InChIInChI=1S/C8H20NOP/c1-6-10-11-9(7(2)3)8(4)5/h7-8,11H,6H2,1-5H3
InChIKeyQQYOFKDTJQXWDP-UHFFFAOYSA-N
MW177.23 g/mol
LogP2.65
Rot. Bonds5

About N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine

N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine (PubChem CID 16697629) has the molecular formula C8H20NOP and a molecular weight of 177.23 g/mol. Its IUPAC name is N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine
PubChem CID16697629
Molecular FormulaC8H20NOP
Molecular Weight177.23 g/mol
Exact Mass177.13
IUPAC NameN-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine
SMILESCCOPN(C(C)C)C(C)C
InChIInChI=1S/C8H20NOP/c1-6-10-11-9(7(2)3)8(4)5/h7-8,11H,6H2,1-5H3
InChIKeyQQYOFKDTJQXWDP-UHFFFAOYSA-N
XLogP2.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine (CID 16697629) is N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine is CCOPN(C(C)C)C(C)C.
What is the InChIKey of N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The InChIKey is QQYOFKDTJQXWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20NOP/c1-6-10-11-9(7(2)3)8(4)5/h7-8,11H,6H2,1-5H3.
What are the key properties of N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine has a molecular weight of 177.23 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxyphosphanyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 16697629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).