2-[amino(propan-2-yloxy)phosphanyl]oxypropane

C6H16NO2P — CID 22572533

IUPAC2-[amino(propan-2-yloxy)phosphanyl]oxypropane
SMILESCC(C)OP(N)OC(C)C
InChIInChI=1S/C6H16NO2P/c1-5(2)8-10(7)9-6(3)4/h5-6H,7H2,1-4H3
InChIKeyBIVIXXXEPPIGSS-UHFFFAOYSA-N
MW165.17 g/mol
LogP2.02
Rot. Bonds4

About 2-[amino(propan-2-yloxy)phosphanyl]oxypropane

2-[amino(propan-2-yloxy)phosphanyl]oxypropane (PubChem CID 22572533) has the molecular formula C6H16NO2P and a molecular weight of 165.17 g/mol. Its IUPAC name is 2-[amino(propan-2-yloxy)phosphanyl]oxypropane.

Molecular Properties

Compound Name2-[amino(propan-2-yloxy)phosphanyl]oxypropane
PubChem CID22572533
Molecular FormulaC6H16NO2P
Molecular Weight165.17 g/mol
Exact Mass165.09
IUPAC Name2-[amino(propan-2-yloxy)phosphanyl]oxypropane
SMILESCC(C)OP(N)OC(C)C
InChIInChI=1S/C6H16NO2P/c1-5(2)8-10(7)9-6(3)4/h5-6H,7H2,1-4H3
InChIKeyBIVIXXXEPPIGSS-UHFFFAOYSA-N
XLogP2.02
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[amino(propan-2-yloxy)phosphanyl]oxypropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[amino(propan-2-yloxy)phosphanyl]oxypropane?
The IUPAC name of 2-[amino(propan-2-yloxy)phosphanyl]oxypropane (CID 22572533) is 2-[amino(propan-2-yloxy)phosphanyl]oxypropane.
What is the SMILES notation for 2-[amino(propan-2-yloxy)phosphanyl]oxypropane?
The canonical SMILES for 2-[amino(propan-2-yloxy)phosphanyl]oxypropane is CC(C)OP(N)OC(C)C.
What is the InChIKey of 2-[amino(propan-2-yloxy)phosphanyl]oxypropane?
The InChIKey is BIVIXXXEPPIGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NO2P/c1-5(2)8-10(7)9-6(3)4/h5-6H,7H2,1-4H3.
What are the key properties of 2-[amino(propan-2-yloxy)phosphanyl]oxypropane?
2-[amino(propan-2-yloxy)phosphanyl]oxypropane has a molecular weight of 165.17 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(propan-2-yloxy)phosphanyl]oxypropane is sourced from PubChem (CID 22572533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).