N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide

C7H8F3N3O — CID 174802345

IUPACN-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide
SMILESCNC(=O)C1(C(F)(F)F)C=NC=CN1
InChIInChI=1S/C7H8F3N3O/c1-11-5(14)6(7(8,9)10)4-12-2-3-13-6/h2-4,13H,1H3,(H,11,14)
InChIKeyUUAFXGBMHCHULU-UHFFFAOYSA-N
MW207.16 g/mol
LogP0.18
Rot. Bonds1

About N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide

N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide (PubChem CID 174802345) has the molecular formula C7H8F3N3O and a molecular weight of 207.16 g/mol. Its IUPAC name is N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide
PubChem CID174802345
Molecular FormulaC7H8F3N3O
Molecular Weight207.16 g/mol
Exact Mass207.06
IUPAC NameN-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide
SMILESCNC(=O)C1(C(F)(F)F)C=NC=CN1
InChIInChI=1S/C7H8F3N3O/c1-11-5(14)6(7(8,9)10)4-12-2-3-13-6/h2-4,13H,1H3,(H,11,14)
InChIKeyUUAFXGBMHCHULU-UHFFFAOYSA-N
XLogP0.18
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.16
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide?
The IUPAC name of N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide (CID 174802345) is N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide.
What is the SMILES notation for N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide?
The canonical SMILES for N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide is CNC(=O)C1(C(F)(F)F)C=NC=CN1.
What is the InChIKey of N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide?
The InChIKey is UUAFXGBMHCHULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O/c1-11-5(14)6(7(8,9)10)4-12-2-3-13-6/h2-4,13H,1H3,(H,11,14).
What are the key properties of N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide?
N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide has a molecular weight of 207.16 g/mol, XLogP of 0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(trifluoromethyl)-1H-pyrazine-2-carboxamide is sourced from PubChem (CID 174802345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).