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

C8H10F3N3 — CID 83064931

IUPAC3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESCc1nccnc1NCCC(F)(F)F
InChIInChI=1S/C8H10F3N3/c1-6-7(14-5-4-12-6)13-3-2-8(9,10)11/h4-5H,2-3H2,1H3,(H,13,14)
InChIKeyNTGNAJPYAOMZAQ-UHFFFAOYSA-N
MW205.18 g/mol
LogP2.15
Rot. Bonds3

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

3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine (PubChem CID 83064931) has the molecular formula C8H10F3N3 and a molecular weight of 205.18 g/mol. Its IUPAC name is 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
PubChem CID83064931
Molecular FormulaC8H10F3N3
Molecular Weight205.18 g/mol
Exact Mass205.08
IUPAC Name3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESCc1nccnc1NCCC(F)(F)F
InChIInChI=1S/C8H10F3N3/c1-6-7(14-5-4-12-6)13-3-2-8(9,10)11/h4-5H,2-3H2,1H3,(H,13,14)
InChIKeyNTGNAJPYAOMZAQ-UHFFFAOYSA-N
XLogP2.15
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The IUPAC name of 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine (CID 83064931) is 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine.
What is the SMILES notation for 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The canonical SMILES for 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine is Cc1nccnc1NCCC(F)(F)F.
What is the InChIKey of 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The InChIKey is NTGNAJPYAOMZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3/c1-6-7(14-5-4-12-6)13-3-2-8(9,10)11/h4-5H,2-3H2,1H3,(H,13,14).
What are the key properties of 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine has a molecular weight of 205.18 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine is sourced from PubChem (CID 83064931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).