3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine

C5H13FNP — CID 89326726

IUPAC3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine
SMILESCNCCCP(C)F
InChIInChI=1S/C5H13FNP/c1-7-4-3-5-8(2)6/h7H,3-5H2,1-2H3
InChIKeyZBEPASIFEPNCAC-UHFFFAOYSA-N
MW137.14 g/mol
LogP1.59
Rot. Bonds4

About 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine

3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine (PubChem CID 89326726) has the molecular formula C5H13FNP and a molecular weight of 137.14 g/mol. Its IUPAC name is 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine
PubChem CID89326726
Molecular FormulaC5H13FNP
Molecular Weight137.14 g/mol
Exact Mass137.08
IUPAC Name3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine
SMILESCNCCCP(C)F
InChIInChI=1S/C5H13FNP/c1-7-4-3-5-8(2)6/h7H,3-5H2,1-2H3
InChIKeyZBEPASIFEPNCAC-UHFFFAOYSA-N
XLogP1.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine?
The IUPAC name of 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine (CID 89326726) is 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine.
What is the SMILES notation for 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine?
The canonical SMILES for 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine is CNCCCP(C)F.
What is the InChIKey of 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine?
The InChIKey is ZBEPASIFEPNCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13FNP/c1-7-4-3-5-8(2)6/h7H,3-5H2,1-2H3.
What are the key properties of 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine?
3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine has a molecular weight of 137.14 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[fluoro(methyl)phosphanyl]-N-methylpropan-1-amine is sourced from PubChem (CID 89326726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).