(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane

C9H15F3NP — CID 176557252

IUPAC(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane
SMILESCN1CCC(F)(F)C(F)(P)CC12CC2
InChIInChI=1S/C9H15F3NP/c1-13-5-4-8(10,11)9(12,14)6-7(13)2-3-7/h2-6,14H2,1H3
InChIKeyOMJSLNVYNMXMBQ-UHFFFAOYSA-N
MW225.19 g/mol
LogP2.42
Rot. Bonds

About (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane

(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane (PubChem CID 176557252) has the molecular formula C9H15F3NP and a molecular weight of 225.19 g/mol. Its IUPAC name is (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane.

Molecular Properties

Compound Name(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane
PubChem CID176557252
Molecular FormulaC9H15F3NP
Molecular Weight225.19 g/mol
Exact Mass225.09
IUPAC Name(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane
SMILESCN1CCC(F)(F)C(F)(P)CC12CC2
InChIInChI=1S/C9H15F3NP/c1-13-5-4-8(10,11)9(12,14)6-7(13)2-3-7/h2-6,14H2,1H3
InChIKeyOMJSLNVYNMXMBQ-UHFFFAOYSA-N
XLogP2.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.19
LogP ≤ 52.42
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 (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane?
The IUPAC name of (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane (CID 176557252) is (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane.
What is the SMILES notation for (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane?
The canonical SMILES for (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane is CN1CCC(F)(F)C(F)(P)CC12CC2.
What is the InChIKey of (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane?
The InChIKey is OMJSLNVYNMXMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3NP/c1-13-5-4-8(10,11)9(12,14)6-7(13)2-3-7/h2-6,14H2,1H3.
What are the key properties of (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane?
(7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane has a molecular weight of 225.19 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7,7,8-trifluoro-4-methyl-4-azaspiro[2.6]nonan-8-yl)phosphane is sourced from PubChem (CID 176557252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).