methanimidamide;2-(trifluoromethyl)pyridine

C7H8F3N3 — CID 175495104

IUPACmethanimidamide;2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccccn1.[H]/N=C/N
InChIInChI=1S/C6H4F3N.CH4N2/c7-6(8,9)5-3-1-2-4-10-5;2-1-3/h1-4H;1H,(H3,2,3)
InChIKeyPCMHBDGYTOEWFU-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.65
Rot. Bonds

About methanimidamide;2-(trifluoromethyl)pyridine

methanimidamide;2-(trifluoromethyl)pyridine (PubChem CID 175495104) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is methanimidamide;2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Namemethanimidamide;2-(trifluoromethyl)pyridine
PubChem CID175495104
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Namemethanimidamide;2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccccn1.[H]/N=C/N
InChIInChI=1S/C6H4F3N.CH4N2/c7-6(8,9)5-3-1-2-4-10-5;2-1-3/h1-4H;1H,(H3,2,3)
InChIKeyPCMHBDGYTOEWFU-UHFFFAOYSA-N
XLogP1.65
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanimidamide;2-(trifluoromethyl)pyridine?
The IUPAC name of methanimidamide;2-(trifluoromethyl)pyridine (CID 175495104) is methanimidamide;2-(trifluoromethyl)pyridine.
What is the SMILES notation for methanimidamide;2-(trifluoromethyl)pyridine?
The canonical SMILES for methanimidamide;2-(trifluoromethyl)pyridine is FC(F)(F)c1ccccn1.[H]/N=C/N.
What is the InChIKey of methanimidamide;2-(trifluoromethyl)pyridine?
The InChIKey is PCMHBDGYTOEWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3N.CH4N2/c7-6(8,9)5-3-1-2-4-10-5;2-1-3/h1-4H;1H,(H3,2,3).
What are the key properties of methanimidamide;2-(trifluoromethyl)pyridine?
methanimidamide;2-(trifluoromethyl)pyridine has a molecular weight of 191.16 g/mol, XLogP of 1.65, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanimidamide;2-(trifluoromethyl)pyridine is sourced from PubChem (CID 175495104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).