N,N-dimethylmethanamine;trifluoroborane

C3H9BF3N — CID 22930251

IUPACN,N-dimethylmethanamine;trifluoroborane
SMILESCN(C)C.FB(F)F
InChIInChI=1S/C3H9N.BF3/c1-4(2)3;2-1(3)4/h1-3H3;
InChIKeyQWDCGMCLKHZVNI-UHFFFAOYSA-N
MW126.92 g/mol
LogP1.06
Rot. Bonds

About N,N-dimethylmethanamine;trifluoroborane

N,N-dimethylmethanamine;trifluoroborane (PubChem CID 22930251) has the molecular formula C3H9BF3N and a molecular weight of 126.92 g/mol. Its IUPAC name is N,N-dimethylmethanamine;trifluoroborane.

Molecular Properties

Compound NameN,N-dimethylmethanamine;trifluoroborane
PubChem CID22930251
Molecular FormulaC3H9BF3N
Molecular Weight126.92 g/mol
Exact Mass127.08
IUPAC NameN,N-dimethylmethanamine;trifluoroborane
SMILESCN(C)C.FB(F)F
InChIInChI=1S/C3H9N.BF3/c1-4(2)3;2-1(3)4/h1-3H3;
InChIKeyQWDCGMCLKHZVNI-UHFFFAOYSA-N
XLogP1.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.92
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;trifluoroborane?
The IUPAC name of N,N-dimethylmethanamine;trifluoroborane (CID 22930251) is N,N-dimethylmethanamine;trifluoroborane.
What is the SMILES notation for N,N-dimethylmethanamine;trifluoroborane?
The canonical SMILES for N,N-dimethylmethanamine;trifluoroborane is CN(C)C.FB(F)F.
What is the InChIKey of N,N-dimethylmethanamine;trifluoroborane?
The InChIKey is QWDCGMCLKHZVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.BF3/c1-4(2)3;2-1(3)4/h1-3H3;.
What are the key properties of N,N-dimethylmethanamine;trifluoroborane?
N,N-dimethylmethanamine;trifluoroborane has a molecular weight of 126.92 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;trifluoroborane is sourced from PubChem (CID 22930251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).