2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine

C9H9F3N4 — CID 103117584

IUPAC2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine
SMILESFC(F)(F)CNCc1cnn2ccncc12
InChIInChI=1S/C9H9F3N4/c10-9(11,12)6-14-3-7-4-15-16-2-1-13-5-8(7)16/h1-2,4-5,14H,3,6H2
InChIKeyCZWWWYATNHJZRC-UHFFFAOYSA-N
MW230.19 g/mol
LogP1.38
Rot. Bonds3

About 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine

2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine (PubChem CID 103117584) has the molecular formula C9H9F3N4 and a molecular weight of 230.19 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine
PubChem CID103117584
Molecular FormulaC9H9F3N4
Molecular Weight230.19 g/mol
Exact Mass230.08
IUPAC Name2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine
SMILESFC(F)(F)CNCc1cnn2ccncc12
InChIInChI=1S/C9H9F3N4/c10-9(11,12)6-14-3-7-4-15-16-2-1-13-5-8(7)16/h1-2,4-5,14H,3,6H2
InChIKeyCZWWWYATNHJZRC-UHFFFAOYSA-N
XLogP1.38
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Pyrazolo(1,5-a)pyrazin-3-amine
CID 69460984
6,7-Dimethylpyrazolo(1,5-a)pyrazin-3-amine dihydrochloride
CID 165770821
Pyrazolo[1,5-a]pyrazine
CID 21873758
4-(4,4-difluorocyclohexyl)-2-pyrazolo[1,5-a]pyrazin-3-yl-1H-pyrimidine-4,5-diamine
CID 144296900
2-[1-(2,2-Difluoroethyl)pyrazol-4-yl]-6-propan-2-ylpyrazine
CID 168209361
3-Fluoro-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
CID 172810484
6-(1-Methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 175743636
7-Fluoropyrazolo[1,5-a]pyrazine
CID 176894498
7-(Trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 176894499
Ethane;6-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 177972712
6-(Difluoromethyl)-3-iodopyrazolo[1,5-a]pyrazine
CID 178051748
2,2-difluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine
CID 103117587

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine (CID 103117584) is 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine is FC(F)(F)CNCc1cnn2ccncc12.
What is the InChIKey of 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine?
The InChIKey is CZWWWYATNHJZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N4/c10-9(11,12)6-14-3-7-4-15-16-2-1-13-5-8(7)16/h1-2,4-5,14H,3,6H2.
What are the key properties of 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine?
2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine has a molecular weight of 230.19 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(pyrazolo[1,5-a]pyrazin-3-ylmethyl)ethanamine is sourced from PubChem (CID 103117584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).