N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine

C3H9F6N3OP4 — CID 23414122

IUPACN-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine
SMILESCN(P(F)F)P(=O)(N(C)P(F)F)N(C)P(F)F
InChIInChI=1S/C3H9F6N3OP4/c1-10(14(4)5)17(13,11(2)15(6)7)12(3)16(8)9/h1-3H3
InChIKeyWSMZRFKVPCYETM-UHFFFAOYSA-N
MW341.01 g/mol
LogP5.39
Rot. Bonds6

About N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine

N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine (PubChem CID 23414122) has the molecular formula C3H9F6N3OP4 and a molecular weight of 341.01 g/mol. Its IUPAC name is N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine.

Molecular Properties

Compound NameN-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine
PubChem CID23414122
Molecular FormulaC3H9F6N3OP4
Molecular Weight341.01 g/mol
Exact Mass340.96
IUPAC NameN-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine
SMILESCN(P(F)F)P(=O)(N(C)P(F)F)N(C)P(F)F
InChIInChI=1S/C3H9F6N3OP4/c1-10(14(4)5)17(13,11(2)15(6)7)12(3)16(8)9/h1-3H3
InChIKeyWSMZRFKVPCYETM-UHFFFAOYSA-N
XLogP5.39
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.01
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[tert-butyl(methyl)phosphoryl]-N-methylmethanamine
CID 54052697
N-[dimethylamino(fluoro)(18F)phosphoryl]-N-methylmethanamine
CID 11367107
N-[methyl-[methyl(oxido)amino]phosphoryl]-N-oxidomethanamine
CID 163539554
dimethylphosphorylmethane;hydron
CID 139251377
CID 21122182
CID 21122182
[dimethylamino(fluorooxy)phosphoryl] hypofluorite
CID 89052570
acetic acid;N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine
CID 174794391
3-N-[bis(dimethylamino)phosphoryl]-3-N-methylbutane-2,3-diamine
CID 54373954
N-[bis(dimethylamino)phosphoryl]-N-methylprop-2-en-1-amine
CID 584619
sodium bis(dimethylamino) phosphate
CID 23665369
2-[fluoro(methyl)phosphoryl]propane
CID 23616463
methylphosphonic acid;trimethylphosphane;hydroiodide
CID 175283104

Frequently Asked Questions

What is the IUPAC name of N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine?
The IUPAC name of N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine (CID 23414122) is N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine.
What is the SMILES notation for N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine?
The canonical SMILES for N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine is CN(P(F)F)P(=O)(N(C)P(F)F)N(C)P(F)F.
What is the InChIKey of N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine?
The InChIKey is WSMZRFKVPCYETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9F6N3OP4/c1-10(14(4)5)17(13,11(2)15(6)7)12(3)16(8)9/h1-3H3.
What are the key properties of N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine?
N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine has a molecular weight of 341.01 g/mol, XLogP of 5.39, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-bis[difluorophosphanyl(methyl)amino]phosphoryl-N-difluorophosphanylmethanamine is sourced from PubChem (CID 23414122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).