N,N'-bis(phosphanyl)azetidine-1-carboximidamide

C4H11N3P2 — CID 20716141

IUPACN,N'-bis(phosphanyl)azetidine-1-carboximidamide
SMILESP/N=C(\NP)N1CCC1
InChIInChI=1S/C4H11N3P2/c8-5-4(6-9)7-2-1-3-7/h1-3,8-9H2,(H,5,6)
InChIKeyDRUQJAOIPWHTFN-UHFFFAOYSA-N
MW163.10 g/mol
LogP0.22
Rot. Bonds

About N,N'-bis(phosphanyl)azetidine-1-carboximidamide

N,N'-bis(phosphanyl)azetidine-1-carboximidamide (PubChem CID 20716141) has the molecular formula C4H11N3P2 and a molecular weight of 163.10 g/mol. Its IUPAC name is N,N'-bis(phosphanyl)azetidine-1-carboximidamide.

Molecular Properties

Compound NameN,N'-bis(phosphanyl)azetidine-1-carboximidamide
PubChem CID20716141
Molecular FormulaC4H11N3P2
Molecular Weight163.10 g/mol
Exact Mass163.04
IUPAC NameN,N'-bis(phosphanyl)azetidine-1-carboximidamide
SMILESP/N=C(\NP)N1CCC1
InChIInChI=1S/C4H11N3P2/c8-5-4(6-9)7-2-1-3-7/h1-3,8-9H2,(H,5,6)
InChIKeyDRUQJAOIPWHTFN-UHFFFAOYSA-N
XLogP0.22
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.10
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(phosphanyl)azetidine-1-carboximidamide?
The IUPAC name of N,N'-bis(phosphanyl)azetidine-1-carboximidamide (CID 20716141) is N,N'-bis(phosphanyl)azetidine-1-carboximidamide.
What is the SMILES notation for N,N'-bis(phosphanyl)azetidine-1-carboximidamide?
The canonical SMILES for N,N'-bis(phosphanyl)azetidine-1-carboximidamide is P/N=C(\NP)N1CCC1.
What is the InChIKey of N,N'-bis(phosphanyl)azetidine-1-carboximidamide?
The InChIKey is DRUQJAOIPWHTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3P2/c8-5-4(6-9)7-2-1-3-7/h1-3,8-9H2,(H,5,6).
What are the key properties of N,N'-bis(phosphanyl)azetidine-1-carboximidamide?
N,N'-bis(phosphanyl)azetidine-1-carboximidamide has a molecular weight of 163.10 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(phosphanyl)azetidine-1-carboximidamide is sourced from PubChem (CID 20716141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).