(4-nitrosopyrrolidin-2-yl)phosphane

C4H9N2OP — CID 122634528

IUPAC(4-nitrosopyrrolidin-2-yl)phosphane
SMILESO=NC1CNC(P)C1
InChIInChI=1S/C4H9N2OP/c7-6-3-1-4(8)5-2-3/h3-5H,1-2,8H2
InChIKeyPNMIKKOCORHMFX-UHFFFAOYSA-N
MW132.10 g/mol
LogP0.32
Rot. Bonds1

About (4-nitrosopyrrolidin-2-yl)phosphane

(4-nitrosopyrrolidin-2-yl)phosphane (PubChem CID 122634528) has the molecular formula C4H9N2OP and a molecular weight of 132.10 g/mol. Its IUPAC name is (4-nitrosopyrrolidin-2-yl)phosphane.

Molecular Properties

Compound Name(4-nitrosopyrrolidin-2-yl)phosphane
PubChem CID122634528
Molecular FormulaC4H9N2OP
Molecular Weight132.10 g/mol
Exact Mass132.05
IUPAC Name(4-nitrosopyrrolidin-2-yl)phosphane
SMILESO=NC1CNC(P)C1
InChIInChI=1S/C4H9N2OP/c7-6-3-1-4(8)5-2-3/h3-5H,1-2,8H2
InChIKeyPNMIKKOCORHMFX-UHFFFAOYSA-N
XLogP0.32
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.10
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4-nitrosopyrrolidin-2-yl)phosphane?
The IUPAC name of (4-nitrosopyrrolidin-2-yl)phosphane (CID 122634528) is (4-nitrosopyrrolidin-2-yl)phosphane.
What is the SMILES notation for (4-nitrosopyrrolidin-2-yl)phosphane?
The canonical SMILES for (4-nitrosopyrrolidin-2-yl)phosphane is O=NC1CNC(P)C1.
What is the InChIKey of (4-nitrosopyrrolidin-2-yl)phosphane?
The InChIKey is PNMIKKOCORHMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N2OP/c7-6-3-1-4(8)5-2-3/h3-5H,1-2,8H2.
What are the key properties of (4-nitrosopyrrolidin-2-yl)phosphane?
(4-nitrosopyrrolidin-2-yl)phosphane has a molecular weight of 132.10 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-nitrosopyrrolidin-2-yl)phosphane is sourced from PubChem (CID 122634528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).