N-[dimethylamino(fluoro)phosphoryl]propan-2-amine

C5H14FN2OP — CID 154103243

IUPACN-[dimethylamino(fluoro)phosphoryl]propan-2-amine
SMILESCC(C)NP(=O)(F)N(C)C
InChIInChI=1S/C5H14FN2OP/c1-5(2)7-10(6,9)8(3)4/h5H,1-4H3,(H,7,9)
InChIKeyXXWPHBWBNJKLMD-UHFFFAOYSA-N
MW168.15 g/mol
LogP1.62
Rot. Bonds3

About N-[dimethylamino(fluoro)phosphoryl]propan-2-amine

N-[dimethylamino(fluoro)phosphoryl]propan-2-amine (PubChem CID 154103243) has the molecular formula C5H14FN2OP and a molecular weight of 168.15 g/mol. Its IUPAC name is N-[dimethylamino(fluoro)phosphoryl]propan-2-amine.

Molecular Properties

Compound NameN-[dimethylamino(fluoro)phosphoryl]propan-2-amine
PubChem CID154103243
Molecular FormulaC5H14FN2OP
Molecular Weight168.15 g/mol
Exact Mass168.08
IUPAC NameN-[dimethylamino(fluoro)phosphoryl]propan-2-amine
SMILESCC(C)NP(=O)(F)N(C)C
InChIInChI=1S/C5H14FN2OP/c1-5(2)7-10(6,9)8(3)4/h5H,1-4H3,(H,7,9)
InChIKeyXXWPHBWBNJKLMD-UHFFFAOYSA-N
XLogP1.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 51.62
H-Bond Donors ≤ 51
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-[dimethylamino(fluoro)phosphoryl]propan-2-amine?
The IUPAC name of N-[dimethylamino(fluoro)phosphoryl]propan-2-amine (CID 154103243) is N-[dimethylamino(fluoro)phosphoryl]propan-2-amine.
What is the SMILES notation for N-[dimethylamino(fluoro)phosphoryl]propan-2-amine?
The canonical SMILES for N-[dimethylamino(fluoro)phosphoryl]propan-2-amine is CC(C)NP(=O)(F)N(C)C.
What is the InChIKey of N-[dimethylamino(fluoro)phosphoryl]propan-2-amine?
The InChIKey is XXWPHBWBNJKLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14FN2OP/c1-5(2)7-10(6,9)8(3)4/h5H,1-4H3,(H,7,9).
What are the key properties of N-[dimethylamino(fluoro)phosphoryl]propan-2-amine?
N-[dimethylamino(fluoro)phosphoryl]propan-2-amine has a molecular weight of 168.15 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethylamino(fluoro)phosphoryl]propan-2-amine is sourced from PubChem (CID 154103243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).