N-(3,3,3-trifluoropropyl)pyrazin-2-amine

C7H8F3N3 — CID 63226687

IUPACN-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESFC(F)(F)CCNc1cnccn1
InChIInChI=1S/C7H8F3N3/c8-7(9,10)1-2-12-6-5-11-3-4-13-6/h3-5H,1-2H2,(H,12,13)
InChIKeyNRMXFPIONFSLSL-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.84
Rot. Bonds3

About N-(3,3,3-trifluoropropyl)pyrazin-2-amine

N-(3,3,3-trifluoropropyl)pyrazin-2-amine (PubChem CID 63226687) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is N-(3,3,3-trifluoropropyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(3,3,3-trifluoropropyl)pyrazin-2-amine
PubChem CID63226687
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC NameN-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESFC(F)(F)CCNc1cnccn1
InChIInChI=1S/C7H8F3N3/c8-7(9,10)1-2-12-6-5-11-3-4-13-6/h3-5H,1-2H2,(H,12,13)
InChIKeyNRMXFPIONFSLSL-UHFFFAOYSA-N
XLogP1.84
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The IUPAC name of N-(3,3,3-trifluoropropyl)pyrazin-2-amine (CID 63226687) is N-(3,3,3-trifluoropropyl)pyrazin-2-amine.
What is the SMILES notation for N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The canonical SMILES for N-(3,3,3-trifluoropropyl)pyrazin-2-amine is FC(F)(F)CCNc1cnccn1.
What is the InChIKey of N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The InChIKey is NRMXFPIONFSLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3/c8-7(9,10)1-2-12-6-5-11-3-4-13-6/h3-5H,1-2H2,(H,12,13).
What are the key properties of N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
N-(3,3,3-trifluoropropyl)pyrazin-2-amine has a molecular weight of 191.16 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,3-trifluoropropyl)pyrazin-2-amine is sourced from PubChem (CID 63226687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).