6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine

C11H12F3N5O — CID 106774700

IUPAC6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCNc1cc(Oc2cc(C)nn2C)nc(C(F)(F)F)n1
InChIInChI=1S/C11H12F3N5O/c1-6-4-9(19(3)18-6)20-8-5-7(15-2)16-10(17-8)11(12,13)14/h4-5H,1-3H3,(H,15,16,17)
InChIKeyUAMWRGKNHLLVRN-UHFFFAOYSA-N
MW287.25 g/mol
LogP2.37
Rot. Bonds3

About 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine

6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 106774700) has the molecular formula C11H12F3N5O and a molecular weight of 287.25 g/mol. Its IUPAC name is 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
PubChem CID106774700
Molecular FormulaC11H12F3N5O
Molecular Weight287.25 g/mol
Exact Mass287.10
IUPAC Name6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCNc1cc(Oc2cc(C)nn2C)nc(C(F)(F)F)n1
InChIInChI=1S/C11H12F3N5O/c1-6-4-9(19(3)18-6)20-8-5-7(15-2)16-10(17-8)11(12,13)14/h4-5H,1-3H3,(H,15,16,17)
InChIKeyUAMWRGKNHLLVRN-UHFFFAOYSA-N
XLogP2.37
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.25
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Dulcerozine
CID 87753
Pyrimidine, 4-methoxy-6-(5-methoxy-3-methylpyrazol-1-yl)-2-methyl-
CID 211219
5-Ethoxy-2-methyl-7-trifluoromethylpyrazolo-[1,5-a]pyrimidine
CID 42640735
N-(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-ylmethyl)-2-(methoxymethyl)-6-methylpyrimidin-4-amine
CID 126823550
2-Amino-4-(1-methyl-3-trifluoromethylpyrazol-5-yloxy)-5-methylpyrimidine
CID 12056711
2-Iodo-6-(1-methyl-3-trifluoromethylpyrazol-5-yloxy)-5-methylpyrimidine
CID 12056712
2-Chloro-6-methyl-4-(1-methyl-3-trifluoromethyl-5-pyrazolyloxy)pyrimidine
CID 53771522
5-Fluoro-2-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyrimidin-4-amine
CID 57818559
(1R)-1-[4-ethyl-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-1,2,4-triazol-3-yl]ethanamine
CID 58499881
7-Methoxy-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 130287500
5-Methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrimidine
CID 141107683
4-[1-Methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrimidin-5-amine
CID 141107727

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine (CID 106774700) is 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine is CNc1cc(Oc2cc(C)nn2C)nc(C(F)(F)F)n1.
What is the InChIKey of 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is UAMWRGKNHLLVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N5O/c1-6-4-9(19(3)18-6)20-8-5-7(15-2)16-10(17-8)11(12,13)14/h4-5H,1-3H3,(H,15,16,17).
What are the key properties of 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 287.25 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 106774700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).