6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine

C11H15N5 — CID 103132081

IUPAC6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(N)ncnc1-c1ccn(C)n1
InChIInChI=1S/C11H15N5/c1-7(2)9-10(13-6-14-11(9)12)8-4-5-16(3)15-8/h4-7H,1-3H3,(H2,12,13,14)
InChIKeyLGMLUMBIAJNARY-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.58
Rot. Bonds2

About 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine

6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 103132081) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID103132081
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(N)ncnc1-c1ccn(C)n1
InChIInChI=1S/C11H15N5/c1-7(2)9-10(13-6-14-11(9)12)8-4-5-16(3)15-8/h4-7H,1-3H3,(H2,12,13,14)
InChIKeyLGMLUMBIAJNARY-UHFFFAOYSA-N
XLogP1.58
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.58
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)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine (CID 103132081) is 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(N)ncnc1-c1ccn(C)n1.
What is the InChIKey of 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is LGMLUMBIAJNARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-7(2)9-10(13-6-14-11(9)12)8-4-5-16(3)15-8/h4-7H,1-3H3,(H2,12,13,14).
What are the key properties of 6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine?
6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 217.28 g/mol, XLogP of 1.58, 2 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)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 103132081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).