2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C10H13F3N4O — CID 133468920

IUPAC2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCc1cnc(C)c(NCC(=O)NCC(F)(F)F)n1
InChIInChI=1S/C10H13F3N4O/c1-6-3-14-7(2)9(17-6)15-4-8(18)16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyHVDRZZPNNWGZMA-UHFFFAOYSA-N
MW262.23 g/mol
LogP1.18
Rot. Bonds4

About 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 133468920) has the molecular formula C10H13F3N4O and a molecular weight of 262.23 g/mol. Its IUPAC name is 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID133468920
Molecular FormulaC10H13F3N4O
Molecular Weight262.23 g/mol
Exact Mass262.10
IUPAC Name2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCc1cnc(C)c(NCC(=O)NCC(F)(F)F)n1
InChIInChI=1S/C10H13F3N4O/c1-6-3-14-7(2)9(17-6)15-4-8(18)16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyHVDRZZPNNWGZMA-UHFFFAOYSA-N
XLogP1.18
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 133468920) is 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide is Cc1cnc(C)c(NCC(=O)NCC(F)(F)F)n1.
What is the InChIKey of 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is HVDRZZPNNWGZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N4O/c1-6-3-14-7(2)9(17-6)15-4-8(18)16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 262.23 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,6-dimethylpyrazin-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 133468920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).