(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane

C9H21NP2 — CID 58321902

IUPAC(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane
SMILESCN1CC(P(C)C)C(P(C)C)C1
InChIInChI=1S/C9H21NP2/c1-10-6-8(11(2)3)9(7-10)12(4)5/h8-9H,6-7H2,1-5H3
InChIKeyYDQCDOXCDBHQHZ-UHFFFAOYSA-N
MW205.22 g/mol
LogP2.15
Rot. Bonds2

About (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane

(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane (PubChem CID 58321902) has the molecular formula C9H21NP2 and a molecular weight of 205.22 g/mol. Its IUPAC name is (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane.

Molecular Properties

Compound Name(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane
PubChem CID58321902
Molecular FormulaC9H21NP2
Molecular Weight205.22 g/mol
Exact Mass205.11
IUPAC Name(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane
SMILESCN1CC(P(C)C)C(P(C)C)C1
InChIInChI=1S/C9H21NP2/c1-10-6-8(11(2)3)9(7-10)12(4)5/h8-9H,6-7H2,1-5H3
InChIKeyYDQCDOXCDBHQHZ-UHFFFAOYSA-N
XLogP2.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 52.15
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 (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane?
The IUPAC name of (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane (CID 58321902) is (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane.
What is the SMILES notation for (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane?
The canonical SMILES for (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane is CN1CC(P(C)C)C(P(C)C)C1.
What is the InChIKey of (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane?
The InChIKey is YDQCDOXCDBHQHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NP2/c1-10-6-8(11(2)3)9(7-10)12(4)5/h8-9H,6-7H2,1-5H3.
What are the key properties of (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane?
(4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane has a molecular weight of 205.22 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-dimethylphosphanyl-1-methylpyrrolidin-3-yl)-dimethylphosphane is sourced from PubChem (CID 58321902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).