(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane

C6H13FNP — CID 145338627

IUPAC(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane
SMILESFC(P)CN1CCCC1
InChIInChI=1S/C6H13FNP/c7-6(9)5-8-3-1-2-4-8/h6H,1-5,9H2
InChIKeyTUWIFNXMMZMNER-UHFFFAOYSA-N
MW149.15 g/mol
LogP1.25
Rot. Bonds2

About (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane

(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane (PubChem CID 145338627) has the molecular formula C6H13FNP and a molecular weight of 149.15 g/mol. Its IUPAC name is (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane.

Molecular Properties

Compound Name(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane
PubChem CID145338627
Molecular FormulaC6H13FNP
Molecular Weight149.15 g/mol
Exact Mass149.08
IUPAC Name(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane
SMILESFC(P)CN1CCCC1
InChIInChI=1S/C6H13FNP/c7-6(9)5-8-3-1-2-4-8/h6H,1-5,9H2
InChIKeyTUWIFNXMMZMNER-UHFFFAOYSA-N
XLogP1.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane?
The IUPAC name of (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane (CID 145338627) is (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane.
What is the SMILES notation for (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane?
The canonical SMILES for (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane is FC(P)CN1CCCC1.
What is the InChIKey of (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane?
The InChIKey is TUWIFNXMMZMNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FNP/c7-6(9)5-8-3-1-2-4-8/h6H,1-5,9H2.
What are the key properties of (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane?
(1-fluoro-2-pyrrolidin-1-ylethyl)phosphane has a molecular weight of 149.15 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-fluoro-2-pyrrolidin-1-ylethyl)phosphane is sourced from PubChem (CID 145338627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).