N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine

C3H6Cl4NP — CID 2785258

IUPACN-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine
SMILESCN(C)P(Cl)C(Cl)(Cl)Cl
InChIInChI=1S/C3H6Cl4NP/c1-8(2)9(7)3(4,5)6/h1-2H3
InChIKeyHWGGXKPARCKHEU-UHFFFAOYSA-N
MW228.87 g/mol
LogP3.43
Rot. Bonds1

About N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine

N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine (PubChem CID 2785258) has the molecular formula C3H6Cl4NP and a molecular weight of 228.87 g/mol. Its IUPAC name is N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine
PubChem CID2785258
Molecular FormulaC3H6Cl4NP
Molecular Weight228.87 g/mol
Exact Mass226.90
IUPAC NameN-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine
SMILESCN(C)P(Cl)C(Cl)(Cl)Cl
InChIInChI=1S/C3H6Cl4NP/c1-8(2)9(7)3(4,5)6/h1-2H3
InChIKeyHWGGXKPARCKHEU-UHFFFAOYSA-N
XLogP3.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.87
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,1,1,1-tetrachloro-N-methylmethanamine
CID 174863987
N-methyl-N-(trichloromethyl)thiohydroxylamine
CID 88816877
N-[bis(trichloromethyl)phosphanyl]-N-propan-2-ylpropan-2-amine
CID 2305215
2-[[bis(trimethylsilyl)amino]-chlorophosphanyl]-2-methylpropane
CID 12622645
1-[tert-butyl(dimethylamino)phosphanyl]-N,N-dimethylmethanamine
CID 102022242
1,1,1-trichloro-2-methyl-2-[(2-methylpropan-2-yl)oxy]propane
CID 59551347
N,N-dimethylformamide;1,1,1,2,2,2-hexachloroethane
CID 174821411
1-chloro-1-N,1-N,1-N',1-N',2-pentamethyl-2-silylpropane-1,1-diamine
CID 173059343
1-chloro-N,N,2,2-tetramethyl-1-silylpropan-1-amine
CID 173064764
CID 6397294
CID 6397294
2,2-dichloropropane;zinc
CID 162195997
N-[dimethylamino-[1,2,2-tris[bis(dimethylamino)phosphanyl]ethyl]phosphanyl]-N-methylmethanamine
CID 139922538

Frequently Asked Questions

What is the IUPAC name of N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine?
The IUPAC name of N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine (CID 2785258) is N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine.
What is the SMILES notation for N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine?
The canonical SMILES for N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine is CN(C)P(Cl)C(Cl)(Cl)Cl.
What is the InChIKey of N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine?
The InChIKey is HWGGXKPARCKHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6Cl4NP/c1-8(2)9(7)3(4,5)6/h1-2H3.
What are the key properties of N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine?
N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine has a molecular weight of 228.87 g/mol, XLogP of 3.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloro(trichloromethyl)phosphanyl]-N-methylmethanamine is sourced from PubChem (CID 2785258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).