5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine

C8H8FN5O — CID 81341512

IUPAC5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine
SMILESCc1cc(Oc2nc(N)ncc2F)n[nH]1
InChIInChI=1S/C8H8FN5O/c1-4-2-6(14-13-4)15-7-5(9)3-11-8(10)12-7/h2-3H,1H3,(H,13,14)(H2,10,11,12)
InChIKeyLQBRFINPHNXHHX-UHFFFAOYSA-N
MW209.18 g/mol
LogP1.02
Rot. Bonds2

About 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine

5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine (PubChem CID 81341512) has the molecular formula C8H8FN5O and a molecular weight of 209.18 g/mol. Its IUPAC name is 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine.

Molecular Properties

Compound Name5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine
PubChem CID81341512
Molecular FormulaC8H8FN5O
Molecular Weight209.18 g/mol
Exact Mass209.07
IUPAC Name5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine
SMILESCc1cc(Oc2nc(N)ncc2F)n[nH]1
InChIInChI=1S/C8H8FN5O/c1-4-2-6(14-13-4)15-7-5(9)3-11-8(10)12-7/h2-3H,1H3,(H,13,14)(H2,10,11,12)
InChIKeyLQBRFINPHNXHHX-UHFFFAOYSA-N
XLogP1.02
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.18
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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
4-Methoxy-6-methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
CID 59533461
2-(2-Ethylpyrazol-3-yl)oxy-5-fluoro-4-methylpyrimidine
CID 118311848
5-Chloro-2-[3-methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-5-yloxy]pyrimidine
CID 132512669
5-Bromo-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrimidine
CID 141107657
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
5-fluoro-4-methoxy-2-(1H-pyrazol-5-yl)pyrimidine
CID 142622711
5-chloro-2-[[5-(trifluoromethyl)-1H-pyrazol-3-yl]oxy]pyrimidine
CID 162441319

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine?
The IUPAC name of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine (CID 81341512) is 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine.
What is the SMILES notation for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine?
The canonical SMILES for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine is Cc1cc(Oc2nc(N)ncc2F)n[nH]1.
What is the InChIKey of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine?
The InChIKey is LQBRFINPHNXHHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN5O/c1-4-2-6(14-13-4)15-7-5(9)3-11-8(10)12-7/h2-3H,1H3,(H,13,14)(H2,10,11,12).
What are the key properties of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine?
5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine has a molecular weight of 209.18 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrimidin-2-amine is sourced from PubChem (CID 81341512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).