6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine

C11H15N5 — CID 103132092

IUPAC6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(-c2ccn(C)n2)n1
InChIInChI=1S/C11H15N5/c1-3-4-11-13-9(7-10(12)14-11)8-5-6-16(2)15-8/h5-7H,3-4H2,1-2H3,(H2,12,13,14)
InChIKeyPBMOCLULQJXYLK-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.41
Rot. Bonds3

About 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine

6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine (PubChem CID 103132092) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine
PubChem CID103132092
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(-c2ccn(C)n2)n1
InChIInChI=1S/C11H15N5/c1-3-4-11-13-9(7-10(12)14-11)8-5-6-16(2)15-8/h5-7H,3-4H2,1-2H3,(H2,12,13,14)
InChIKeyPBMOCLULQJXYLK-UHFFFAOYSA-N
XLogP1.41
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine (CID 103132092) is 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine is CCCc1nc(N)cc(-c2ccn(C)n2)n1.
What is the InChIKey of 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine?
The InChIKey is PBMOCLULQJXYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-3-4-11-13-9(7-10(12)14-11)8-5-6-16(2)15-8/h5-7H,3-4H2,1-2H3,(H2,12,13,14).
What are the key properties of 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine?
6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine has a molecular weight of 217.28 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 103132092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).