N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine

C10H10F3N5O — CID 114566614

IUPACN-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(Oc2cnn(C)c2)cc(C(F)(F)F)n1
InChIInChI=1S/C10H10F3N5O/c1-14-9-16-7(10(11,12)13)3-8(17-9)19-6-4-15-18(2)5-6/h3-5H,1-2H3,(H,14,16,17)
InChIKeyMILCWPBFZYYSAE-UHFFFAOYSA-N
MW273.22 g/mol
LogP2.06
Rot. Bonds3

About N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine

N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine (PubChem CID 114566614) has the molecular formula C10H10F3N5O and a molecular weight of 273.22 g/mol. Its IUPAC name is N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine
PubChem CID114566614
Molecular FormulaC10H10F3N5O
Molecular Weight273.22 g/mol
Exact Mass273.08
IUPAC NameN-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(Oc2cnn(C)c2)cc(C(F)(F)F)n1
InChIInChI=1S/C10H10F3N5O/c1-14-9-16-7(10(11,12)13)3-8(17-9)19-6-4-15-18(2)5-6/h3-5H,1-2H3,(H,14,16,17)
InChIKeyMILCWPBFZYYSAE-UHFFFAOYSA-N
XLogP2.06
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.22
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,4-dimethyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-2-amine
CID 116794381
4-(4-bromo-3-methylphenoxy)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566596
N-methyl-4-(2,2,2-trifluoroethoxy)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566189
4-(2,4-difluorophenoxy)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566298
4-methyl-6-(1-methylpyrazol-4-yl)oxy-N-propylpyrimidin-2-amine
CID 116794496
4-ethoxy-N-methyl-6-(1-methylpyrazol-4-yl)oxy-1,3,5-triazin-2-amine
CID 116794366
[4-(3,5-dimethylphenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567743
4-(2-ethylphenoxy)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566390
2-tert-butyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine
CID 116794520
N-methyl-4-(trifluoromethyl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 114566111
N-methyl-6-(1-propylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774804
2-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyridine-3-carboxamide
CID 116792710

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine?
The IUPAC name of N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine (CID 114566614) is N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine is CNc1nc(Oc2cnn(C)c2)cc(C(F)(F)F)n1.
What is the InChIKey of N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine?
The InChIKey is MILCWPBFZYYSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N5O/c1-14-9-16-7(10(11,12)13)3-8(17-9)19-6-4-15-18(2)5-6/h3-5H,1-2H3,(H,14,16,17).
What are the key properties of N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine?
N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine has a molecular weight of 273.22 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-methylpyrazol-4-yl)oxy-6-(trifluoromethyl)pyrimidin-2-amine is sourced from PubChem (CID 114566614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).