N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine

C9H21FNOP — CID 102508198

IUPACN-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine
SMILESCCCN(CCC)P(=O)(F)CCC
InChIInChI=1S/C9H21FNOP/c1-4-7-11(8-5-2)13(10,12)9-6-3/h4-9H2,1-3H3
InChIKeyNVZMMFSAHLLTIB-UHFFFAOYSA-N
MW209.24 g/mol
LogP3.68
Rot. Bonds7

About N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine

N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine (PubChem CID 102508198) has the molecular formula C9H21FNOP and a molecular weight of 209.24 g/mol. Its IUPAC name is N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine.

Molecular Properties

Compound NameN-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine
PubChem CID102508198
Molecular FormulaC9H21FNOP
Molecular Weight209.24 g/mol
Exact Mass209.13
IUPAC NameN-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine
SMILESCCCN(CCC)P(=O)(F)CCC
InChIInChI=1S/C9H21FNOP/c1-4-7-11(8-5-2)13(10,12)9-6-3/h4-9H2,1-3H3
InChIKeyNVZMMFSAHLLTIB-UHFFFAOYSA-N
XLogP3.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 53.68
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 N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine?
The IUPAC name of N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine (CID 102508198) is N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine.
What is the SMILES notation for N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine?
The canonical SMILES for N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine is CCCN(CCC)P(=O)(F)CCC.
What is the InChIKey of N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine?
The InChIKey is NVZMMFSAHLLTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21FNOP/c1-4-7-11(8-5-2)13(10,12)9-6-3/h4-9H2,1-3H3.
What are the key properties of N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine?
N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine has a molecular weight of 209.24 g/mol, XLogP of 3.68, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[fluoro(propyl)phosphoryl]-N-propylpropan-1-amine is sourced from PubChem (CID 102508198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).