1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol

C13H16N4O — CID 170782936

IUPAC1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol
SMILESOC1CCN(c2cc(C3CC3)nc3ccnn23)C1
InChIInChI=1S/C13H16N4O/c18-10-4-6-16(8-10)13-7-11(9-1-2-9)15-12-3-5-14-17(12)13/h3,5,7,9-10,18H,1-2,4,6,8H2
InChIKeyVXPFSZBPXPBLQL-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.18
Rot. Bonds2

About 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol

1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol (PubChem CID 170782936) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol
PubChem CID170782936
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol
SMILESOC1CCN(c2cc(C3CC3)nc3ccnn23)C1
InChIInChI=1S/C13H16N4O/c18-10-4-6-16(8-10)13-7-11(9-1-2-9)15-12-3-5-14-17(12)13/h3,5,7,9-10,18H,1-2,4,6,8H2
InChIKeyVXPFSZBPXPBLQL-UHFFFAOYSA-N
XLogP1.18
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol?
The IUPAC name of 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol (CID 170782936) is 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol is OC1CCN(c2cc(C3CC3)nc3ccnn23)C1.
What is the InChIKey of 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol?
The InChIKey is VXPFSZBPXPBLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c18-10-4-6-16(8-10)13-7-11(9-1-2-9)15-12-3-5-14-17(12)13/h3,5,7,9-10,18H,1-2,4,6,8H2.
What are the key properties of 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol?
1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol has a molecular weight of 244.30 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol is sourced from PubChem (CID 170782936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).