potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane

C9H12BF3KN — CID 175179431

IUPACpotassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane
SMILESFB(F)F.[CH2-]N(C)Cc1ccccc1.[K+]
InChIInChI=1S/C9H12N.BF3.K/c1-10(2)8-9-6-4-3-5-7-9;2-1(3)4;/h3-7H,1,8H2,2H3;;/q-1;;+1
InChIKeyRHXUQAVIYJJGSC-UHFFFAOYSA-N
MW241.11 g/mol
LogP-0.21
Rot. Bonds2

About potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane

potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane (PubChem CID 175179431) has the molecular formula C9H12BF3KN and a molecular weight of 241.11 g/mol. Its IUPAC name is potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane.

Molecular Properties

Compound Namepotassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane
PubChem CID175179431
Molecular FormulaC9H12BF3KN
Molecular Weight241.11 g/mol
Exact Mass241.07
IUPAC Namepotassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane
SMILESFB(F)F.[CH2-]N(C)Cc1ccccc1.[K+]
InChIInChI=1S/C9H12N.BF3.K/c1-10(2)8-9-6-4-3-5-7-9;2-1(3)4;/h3-7H,1,8H2,2H3;;/q-1;;+1
InChIKeyRHXUQAVIYJJGSC-UHFFFAOYSA-N
XLogP-0.21
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.11
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-N-methanidyl-1-phenylmethanamine
CID 20756684
N,N-dimethyl-1-phenylmethanamine;hydrobromide
CID 71398520
N,N-dimethyl-1-phenylmethanamine;phosphane
CID 174524909
N,N-dimethyl-1-phenylmethanamine;tetrahydrochloride
CID 172854351
benzene;N,N-dimethyl-1-phenylmethanamine;ethane
CID 90785154
N,N-dimethyl-1-phenylmethanamine;gold(3+);dichloride
CID 71592559
1-benzyl-1,2,2-trimethylhydrazine
CID 23468062
N-benzyl-1,1,1-trifluoro-N-methylmethanamine
CID 5167579
N,N-dibenzyl-1-fluoropropan-2-amine
CID 70794652
potassium;N,N-dibenzylthiohydroxylamine;hydride;platinum
CID 173162264
CID 134904484
CID 134904484
carbonic acid;N,N-dimethyl-1-phenylmethanamine
CID 69138278

Frequently Asked Questions

What is the IUPAC name of potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane?
The IUPAC name of potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane (CID 175179431) is potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane.
What is the SMILES notation for potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane?
The canonical SMILES for potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane is FB(F)F.[CH2-]N(C)Cc1ccccc1.[K+].
What is the InChIKey of potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane?
The InChIKey is RHXUQAVIYJJGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.BF3.K/c1-10(2)8-9-6-4-3-5-7-9;2-1(3)4;/h3-7H,1,8H2,2H3;;/q-1;;+1.
What are the key properties of potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane?
potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane has a molecular weight of 241.11 g/mol, XLogP of -0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;N-methanidyl-N-methyl-1-phenylmethanamine;trifluoroborane is sourced from PubChem (CID 175179431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).