N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine

C11H15N5O2 — CID 116794457

IUPACN-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine
SMILESCCNc1ncnc(Oc2cnn(C)c2)c1OC
InChIInChI=1S/C11H15N5O2/c1-4-12-10-9(17-3)11(14-7-13-10)18-8-5-15-16(2)6-8/h5-7H,4H2,1-3H3,(H,12,13,14)
InChIKeyCSLUGBDVRUGLKE-UHFFFAOYSA-N
MW249.27 g/mol
LogP1.44
Rot. Bonds5

About N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine

N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine (PubChem CID 116794457) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine
PubChem CID116794457
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC NameN-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine
SMILESCCNc1ncnc(Oc2cnn(C)c2)c1OC
InChIInChI=1S/C11H15N5O2/c1-4-12-10-9(17-3)11(14-7-13-10)18-8-5-15-16(2)6-8/h5-7H,4H2,1-3H3,(H,12,13,14)
InChIKeyCSLUGBDVRUGLKE-UHFFFAOYSA-N
XLogP1.44
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(4-bromo-3,5-dimethylphenoxy)-N-ethyl-5-methoxypyrimidin-4-amine
CID 107727389
6-(1-methylpyrazol-4-yl)oxy-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 116794391
N-ethyl-6-(3-fluoro-4-methylphenoxy)-5-methoxypyrimidin-4-amine
CID 107171811
N-ethyl-5-methoxy-6-(oxetan-3-yloxy)pyrimidin-4-amine
CID 102608811
N-ethyl-6-(1-propan-2-ylpyrazol-4-yl)oxy-5-propylpyrimidin-4-amine
CID 116806444
8-methyl-4-(1-methylpyrazol-4-yl)oxyquinazoline
CID 133487402
N-ethyl-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-5-methoxypyrimidin-4-amine
CID 102723635
N-ethyl-4-(1-methylpyrazol-4-yl)oxythieno[2,3-d]pyrimidin-2-amine
CID 103333500
N-ethyl-6-(4-methoxyphenoxy)-5-methylpyrimidin-4-amine
CID 80870042
6-N-ethyl-5-methoxy-4-N-(2,3,3-trimethylbutyl)pyrimidine-4,6-diamine
CID 83147579
2-N,2-N,4-N-triethyl-6-(1-methylpyrazol-4-yl)oxy-1,3,5-triazine-2,4-diamine
CID 116794456
N-ethyl-5-methoxy-6-(3-propyltriazol-4-yl)pyrimidin-4-amine
CID 114691125

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine?
The IUPAC name of N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine (CID 116794457) is N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine?
The canonical SMILES for N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine is CCNc1ncnc(Oc2cnn(C)c2)c1OC.
What is the InChIKey of N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine?
The InChIKey is CSLUGBDVRUGLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-4-12-10-9(17-3)11(14-7-13-10)18-8-5-15-16(2)6-8/h5-7H,4H2,1-3H3,(H,12,13,14).
What are the key properties of N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine?
N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine has a molecular weight of 249.27 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methoxy-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine is sourced from PubChem (CID 116794457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).