3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide

C9H7F3N4O — CID 141038892

IUPAC3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(F)(F)F)nn2cc(C(N)=O)cnc12
InChIInChI=1S/C9H7F3N4O/c1-4-6(9(10,11)12)15-16-3-5(7(13)17)2-14-8(4)16/h2-3H,1H3,(H2,13,17)
InChIKeyWJEHHZXXRICAGY-UHFFFAOYSA-N
MW244.18 g/mol
LogP1.16
Rot. Bonds1

About 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide

3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 141038892) has the molecular formula C9H7F3N4O and a molecular weight of 244.18 g/mol. Its IUPAC name is 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID141038892
Molecular FormulaC9H7F3N4O
Molecular Weight244.18 g/mol
Exact Mass244.06
IUPAC Name3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(F)(F)F)nn2cc(C(N)=O)cnc12
InChIInChI=1S/C9H7F3N4O/c1-4-6(9(10,11)12)15-16-3-5(7(13)17)2-14-8(4)16/h2-3H,1H3,(H2,13,17)
InChIKeyWJEHHZXXRICAGY-UHFFFAOYSA-N
XLogP1.16
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.18
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-isobutyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 2821351
1-[7-Methyl-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone
CID 2041236
5,7-Dimethylpyrazolo[1,5-A]pyrimidine-3-carboxamide
CID 17593557
N,5,7-trimethylpyrazolo(1,5-a)pyrimidine-3-carboxamide
CID 19440818
2-Methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 1478930
2-Methylpyrazolo[1,5-a]pyrimidine-6-carbaldehyde
CID 45792526
N-[(E)-(dimethylamino)methylidene]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 4322478
2-Methyl-7-(trifluoromethyl)pyrazolo(1,5-a)pyrimidine-3-carbaldehyde
CID 25581325
N-methyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 2821149
1-(5,7-Dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2,2,2-trifluoroethanone
CID 90672684
N-(2,2-difluoroethyl)-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 134795310
N-(2,2-difluoroethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 90374502

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide (CID 141038892) is 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide is Cc1c(C(F)(F)F)nn2cc(C(N)=O)cnc12.
What is the InChIKey of 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is WJEHHZXXRICAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N4O/c1-4-6(9(10,11)12)15-16-3-5(7(13)17)2-14-8(4)16/h2-3H,1H3,(H2,13,17).
What are the key properties of 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide?
3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 244.18 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 141038892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).