3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine

C9H14N2O2P2 — CID 13397214

IUPAC3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine
SMILESCOP1CP(OC)N(c2ccccc2)N1
InChIInChI=1S/C9H14N2O2P2/c1-12-14-8-15(13-2)11(10-14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKeyANBSQXIZSBIPKU-UHFFFAOYSA-N
MW244.17 g/mol
LogP2.89
Rot. Bonds3

About 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine

3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine (PubChem CID 13397214) has the molecular formula C9H14N2O2P2 and a molecular weight of 244.17 g/mol. Its IUPAC name is 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine.

Molecular Properties

Compound Name3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine
PubChem CID13397214
Molecular FormulaC9H14N2O2P2
Molecular Weight244.17 g/mol
Exact Mass244.05
IUPAC Name3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine
SMILESCOP1CP(OC)N(c2ccccc2)N1
InChIInChI=1S/C9H14N2O2P2/c1-12-14-8-15(13-2)11(10-14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKeyANBSQXIZSBIPKU-UHFFFAOYSA-N
XLogP2.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.17
LogP ≤ 52.89
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 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine?
The IUPAC name of 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine (CID 13397214) is 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine.
What is the SMILES notation for 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine?
The canonical SMILES for 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine is COP1CP(OC)N(c2ccccc2)N1.
What is the InChIKey of 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine?
The InChIKey is ANBSQXIZSBIPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2P2/c1-12-14-8-15(13-2)11(10-14)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3.
What are the key properties of 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine?
3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine has a molecular weight of 244.17 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-1-phenyl-1,2,3,5-diazadiphospholidine is sourced from PubChem (CID 13397214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).