2-methyl-1,3,2-diazaphospholidine

C3H9N2P — CID 101134895

IUPAC2-methyl-1,3,2-diazaphospholidine
SMILESCP1NCCN1
InChIInChI=1S/C3H9N2P/c1-6-4-2-3-5-6/h4-5H,2-3H2,1H3
InChIKeyDSPDKNRXZVQAIH-UHFFFAOYSA-N
MW104.09 g/mol
LogP0.12
Rot. Bonds

About 2-methyl-1,3,2-diazaphospholidine

2-methyl-1,3,2-diazaphospholidine (PubChem CID 101134895) has the molecular formula C3H9N2P and a molecular weight of 104.09 g/mol. Its IUPAC name is 2-methyl-1,3,2-diazaphospholidine.

Molecular Properties

Compound Name2-methyl-1,3,2-diazaphospholidine
PubChem CID101134895
Molecular FormulaC3H9N2P
Molecular Weight104.09 g/mol
Exact Mass104.05
IUPAC Name2-methyl-1,3,2-diazaphospholidine
SMILESCP1NCCN1
InChIInChI=1S/C3H9N2P/c1-6-4-2-3-5-6/h4-5H,2-3H2,1H3
InChIKeyDSPDKNRXZVQAIH-UHFFFAOYSA-N
XLogP0.12
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.09
LogP ≤ 50.12
H-Bond Donors ≤ 52
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 2-methyl-1,3,2-diazaphospholidine?
The IUPAC name of 2-methyl-1,3,2-diazaphospholidine (CID 101134895) is 2-methyl-1,3,2-diazaphospholidine.
What is the SMILES notation for 2-methyl-1,3,2-diazaphospholidine?
The canonical SMILES for 2-methyl-1,3,2-diazaphospholidine is CP1NCCN1.
What is the InChIKey of 2-methyl-1,3,2-diazaphospholidine?
The InChIKey is DSPDKNRXZVQAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N2P/c1-6-4-2-3-5-6/h4-5H,2-3H2,1H3.
What are the key properties of 2-methyl-1,3,2-diazaphospholidine?
2-methyl-1,3,2-diazaphospholidine has a molecular weight of 104.09 g/mol, XLogP of 0.12, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3,2-diazaphospholidine is sourced from PubChem (CID 101134895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).