5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine

C11H15N5O2 — CID 116806629

IUPAC5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine
SMILESCOc1c(N)ncnc1Oc1cnn(C(C)C)c1
InChIInChI=1S/C11H15N5O2/c1-7(2)16-5-8(4-15-16)18-11-9(17-3)10(12)13-6-14-11/h4-7H,1-3H3,(H2,12,13,14)
InChIKeyUBILLDCIYCSGPV-UHFFFAOYSA-N
MW249.27 g/mol
LogP1.64
Rot. Bonds4

About 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine

5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine (PubChem CID 116806629) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine.

Molecular Properties

Compound Name5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine
PubChem CID116806629
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC Name5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine
SMILESCOc1c(N)ncnc1Oc1cnn(C(C)C)c1
InChIInChI=1S/C11H15N5O2/c1-7(2)16-5-8(4-15-16)18-11-9(17-3)10(12)13-6-14-11/h4-7H,1-3H3,(H2,12,13,14)
InChIKeyUBILLDCIYCSGPV-UHFFFAOYSA-N
XLogP1.64
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(1-methylpyrazol-4-yl)oxy-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774797
N-methyl-6-(1-methylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774798
N-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774799
6-(1-ethylpyrazol-4-yl)oxy-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774800
N-ethyl-6-(1-ethylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774801
6-(1-Ethylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774803
N-methyl-6-(1-propylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774804
6-(1-Propylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774805
N-methyl-6-(1-propan-2-ylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774806
6-(1-Propan-2-ylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774807
[6-(1-Propan-2-ylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776489
N-ethyl-4-(1-ethylpyrazol-4-yl)oxy-5-fluoropyrimidin-2-amine
CID 113566438

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine?
The IUPAC name of 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine (CID 116806629) is 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine.
What is the SMILES notation for 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine?
The canonical SMILES for 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine is COc1c(N)ncnc1Oc1cnn(C(C)C)c1.
What is the InChIKey of 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine?
The InChIKey is UBILLDCIYCSGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-7(2)16-5-8(4-15-16)18-11-9(17-3)10(12)13-6-14-11/h4-7H,1-3H3,(H2,12,13,14).
What are the key properties of 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine?
5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine has a molecular weight of 249.27 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-amine is sourced from PubChem (CID 116806629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).