6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine

C15H23N5O — CID 81333787

IUPAC6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(Oc2cc(C)nn2C)c1C
InChIInChI=1S/C15H23N5O/c1-6-8-16-14-11(4)15(18-12(7-2)17-14)21-13-9-10(3)19-20(13)5/h9H,6-8H2,1-5H3,(H,16,17,18)
InChIKeyMFWKGLQSQWOXPC-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.00
Rot. Bonds6

About 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine

6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine (PubChem CID 81333787) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
PubChem CID81333787
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(Oc2cc(C)nn2C)c1C
InChIInChI=1S/C15H23N5O/c1-6-8-16-14-11(4)15(18-12(7-2)17-14)21-13-9-10(3)19-20(13)5/h9H,6-8H2,1-5H3,(H,16,17,18)
InChIKeyMFWKGLQSQWOXPC-UHFFFAOYSA-N
XLogP3.00
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine (CID 81333787) is 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine is CCCNc1nc(CC)nc(Oc2cc(C)nn2C)c1C.
What is the InChIKey of 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The InChIKey is MFWKGLQSQWOXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-6-8-16-14-11(4)15(18-12(7-2)17-14)21-13-9-10(3)19-20(13)5/h9H,6-8H2,1-5H3,(H,16,17,18).
What are the key properties of 6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
6-(2,5-dimethylpyrazol-3-yl)oxy-2-ethyl-5-methyl-N-propylpyrimidin-4-amine has a molecular weight of 289.38 g/mol, XLogP of 3.00, 6 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-2-ethyl-5-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 81333787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).