6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine

C13H19N5O — CID 81346478

IUPAC6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(Oc2nc(C(C)C)nc(N)c2C)n(C)n1
InChIInChI=1S/C13H19N5O/c1-7(2)12-15-11(14)9(4)13(16-12)19-10-6-8(3)17-18(10)5/h6-7H,1-5H3,(H2,14,15,16)
InChIKeyUPIRLWQQLUNVGG-UHFFFAOYSA-N
MW261.33 g/mol
LogP2.32
Rot. Bonds3

About 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine

6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 81346478) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID81346478
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(Oc2nc(C(C)C)nc(N)c2C)n(C)n1
InChIInChI=1S/C13H19N5O/c1-7(2)12-15-11(14)9(4)13(16-12)19-10-6-8(3)17-18(10)5/h6-7H,1-5H3,(H2,14,15,16)
InChIKeyUPIRLWQQLUNVGG-UHFFFAOYSA-N
XLogP2.32
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Dulcerozine
CID 87753
Pyrimidine, 4-methoxy-6-(5-methoxy-3-methylpyrazol-1-yl)-2-methyl-
CID 211219
3-Ethyl-5-methyl-7-propoxypyrazolo[1,5-a]pyrimidine
CID 44317958
7-(Cyclopropylmethoxy)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
CID 126954741
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-Methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrimidine
CID 141107683
N-[[4-methyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrimidin-2-yl]methyl]cyclopropanecarboxamide
CID 11638966
4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-propylpyrimidin-2-amine
CID 81345942
4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
CID 81345946
4-(2,5-Dimethylpyrazol-3-yl)oxy-5-fluoropyrimidin-2-amine
CID 81346406

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine (CID 81346478) is 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine is Cc1cc(Oc2nc(C(C)C)nc(N)c2C)n(C)n1.
What is the InChIKey of 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is UPIRLWQQLUNVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-7(2)12-15-11(14)9(4)13(16-12)19-10-6-8(3)17-18(10)5/h6-7H,1-5H3,(H2,14,15,16).
What are the key properties of 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine?
6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 261.33 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 81346478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).