4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine

C10H12FN5O — CID 81345946

IUPAC4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
SMILESCNc1ncc(F)c(Oc2cc(C)nn2C)n1
InChIInChI=1S/C10H12FN5O/c1-6-4-8(16(3)15-6)17-9-7(11)5-13-10(12-2)14-9/h4-5H,1-3H3,(H,12,13,14)
InChIKeyUEGSAUMIHPANQX-UHFFFAOYSA-N
MW237.24 g/mol
LogP1.49
Rot. Bonds3

About 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine

4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine (PubChem CID 81345946) has the molecular formula C10H12FN5O and a molecular weight of 237.24 g/mol. Its IUPAC name is 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
PubChem CID81345946
Molecular FormulaC10H12FN5O
Molecular Weight237.24 g/mol
Exact Mass237.10
IUPAC Name4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
SMILESCNc1ncc(F)c(Oc2cc(C)nn2C)n1
InChIInChI=1S/C10H12FN5O/c1-6-4-8(16(3)15-6)17-9-7(11)5-13-10(12-2)14-9/h4-5H,1-3H3,(H,12,13,14)
InChIKeyUEGSAUMIHPANQX-UHFFFAOYSA-N
XLogP1.49
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.24
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine?
The IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine (CID 81345946) is 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine?
The canonical SMILES for 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine is CNc1ncc(F)c(Oc2cc(C)nn2C)n1.
What is the InChIKey of 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine?
The InChIKey is UEGSAUMIHPANQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN5O/c1-6-4-8(16(3)15-6)17-9-7(11)5-13-10(12-2)14-9/h4-5H,1-3H3,(H,12,13,14).
What are the key properties of 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine?
4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine has a molecular weight of 237.24 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine is sourced from PubChem (CID 81345946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).