3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol

C10H11F3N4O — CID 84806567

IUPAC3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol
SMILESNCCC(O)c1cnc2cc(C(F)(F)F)nn2c1
InChIInChI=1S/C10H11F3N4O/c11-10(12,13)8-3-9-15-4-6(5-17(9)16-8)7(18)1-2-14/h3-5,7,18H,1-2,14H2
InChIKeyICBAWCTTXZFQAU-UHFFFAOYSA-N
MW260.22 g/mol
LogP1.13
Rot. Bonds3

About 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol

3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol (PubChem CID 84806567) has the molecular formula C10H11F3N4O and a molecular weight of 260.22 g/mol. Its IUPAC name is 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol.

Molecular Properties

Compound Name3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol
PubChem CID84806567
Molecular FormulaC10H11F3N4O
Molecular Weight260.22 g/mol
Exact Mass260.09
IUPAC Name3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol
SMILESNCCC(O)c1cnc2cc(C(F)(F)F)nn2c1
InChIInChI=1S/C10H11F3N4O/c11-10(12,13)8-3-9-15-4-6(5-17(9)16-8)7(18)1-2-14/h3-5,7,18H,1-2,14H2
InChIKeyICBAWCTTXZFQAU-UHFFFAOYSA-N
XLogP1.13
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.22
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-Methyl-4-(methylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]propan-1-ol
CID 24874171
3-[(5-Propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclobutan-1-ol
CID 172470094
7-Amino-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-6-methanol
CID 58034477
1-(6-Fluoropyrazolo[1,5-a]pyrimidin-3-yl)butan-1-ol
CID 91149484
(2,2-Difluoroethylamino)-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methanol
CID 124006135
3-(Piperidin-4-ylmethyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 174285975
3-(Piperidin-4-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 174285977
1,1,1-Trifluoro-3-[(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-2-propanol
CID 56896179
N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 62402287
[2-(Trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanol
CID 82271916
1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-N-(2,2,2-trifluoroethoxy)methanamine
CID 82711445
3-[6-(Trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]propan-1-amine
CID 84728422

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol?
The IUPAC name of 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol (CID 84806567) is 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol.
What is the SMILES notation for 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol?
The canonical SMILES for 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol is NCCC(O)c1cnc2cc(C(F)(F)F)nn2c1.
What is the InChIKey of 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol?
The InChIKey is ICBAWCTTXZFQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N4O/c11-10(12,13)8-3-9-15-4-6(5-17(9)16-8)7(18)1-2-14/h3-5,7,18H,1-2,14H2.
What are the key properties of 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol?
3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol has a molecular weight of 260.22 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]propan-1-ol is sourced from PubChem (CID 84806567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).