5-butylpyrazolo[1,5-a]pyrimidin-7-amine

C10H14N4 — CID 19709702

IUPAC5-butylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCCc1cc(N)n2nccc2n1
InChIInChI=1S/C10H14N4/c1-2-3-4-8-7-9(11)14-10(13-8)5-6-12-14/h5-7H,2-4,11H2,1H3
InChIKeyWMLBPFXDYDINND-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.65
Rot. Bonds3

About 5-butylpyrazolo[1,5-a]pyrimidin-7-amine

5-butylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 19709702) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 5-butylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-butylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID19709702
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name5-butylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCCc1cc(N)n2nccc2n1
InChIInChI=1S/C10H14N4/c1-2-3-4-8-7-9(11)14-10(13-8)5-6-12-14/h5-7H,2-4,11H2,1H3
InChIKeyWMLBPFXDYDINND-UHFFFAOYSA-N
XLogP1.65
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-butylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-butylpyrazolo[1,5-a]pyrimidin-7-amine (CID 19709702) is 5-butylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-butylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-butylpyrazolo[1,5-a]pyrimidin-7-amine is CCCCc1cc(N)n2nccc2n1.
What is the InChIKey of 5-butylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is WMLBPFXDYDINND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-2-3-4-8-7-9(11)14-10(13-8)5-6-12-14/h5-7H,2-4,11H2,1H3.
What are the key properties of 5-butylpyrazolo[1,5-a]pyrimidin-7-amine?
5-butylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 190.25 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 19709702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).