2-methoxy-5-phenyl-1,3,2-oxazaphospholidine

C9H12NO2P — CID 70377704

IUPAC2-methoxy-5-phenyl-1,3,2-oxazaphospholidine
SMILESCOP1NCC(c2ccccc2)O1
InChIInChI=1S/C9H12NO2P/c1-11-13-10-7-9(12-13)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3
InChIKeyFSNBPOLMNIJERC-UHFFFAOYSA-N
MW197.17 g/mol
LogP2.22
Rot. Bonds2

About 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine

2-methoxy-5-phenyl-1,3,2-oxazaphospholidine (PubChem CID 70377704) has the molecular formula C9H12NO2P and a molecular weight of 197.17 g/mol. Its IUPAC name is 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine.

Molecular Properties

Compound Name2-methoxy-5-phenyl-1,3,2-oxazaphospholidine
PubChem CID70377704
Molecular FormulaC9H12NO2P
Molecular Weight197.17 g/mol
Exact Mass197.06
IUPAC Name2-methoxy-5-phenyl-1,3,2-oxazaphospholidine
SMILESCOP1NCC(c2ccccc2)O1
InChIInChI=1S/C9H12NO2P/c1-11-13-10-7-9(12-13)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3
InChIKeyFSNBPOLMNIJERC-UHFFFAOYSA-N
XLogP2.22
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.17
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine 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-methoxy-5-phenyl-1,3,2-oxazaphospholidine?
The IUPAC name of 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine (CID 70377704) is 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine.
What is the SMILES notation for 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine?
The canonical SMILES for 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine is COP1NCC(c2ccccc2)O1.
What is the InChIKey of 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine?
The InChIKey is FSNBPOLMNIJERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12NO2P/c1-11-13-10-7-9(12-13)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3.
What are the key properties of 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine?
2-methoxy-5-phenyl-1,3,2-oxazaphospholidine has a molecular weight of 197.17 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-phenyl-1,3,2-oxazaphospholidine is sourced from PubChem (CID 70377704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).