5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C10H11ClN4O — CID 134795552

IUPAC5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESClc1cc(NC2CCOC2)n2nccc2n1
InChIInChI=1S/C10H11ClN4O/c11-8-5-10(13-7-2-4-16-6-7)15-9(14-8)1-3-12-15/h1,3,5,7,13H,2,4,6H2
InChIKeyNAADWJRMEWOKRU-UHFFFAOYSA-N
MW238.68 g/mol
LogP1.58
Rot. Bonds2

About 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 134795552) has the molecular formula C10H11ClN4O and a molecular weight of 238.68 g/mol. Its IUPAC name is 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID134795552
Molecular FormulaC10H11ClN4O
Molecular Weight238.68 g/mol
Exact Mass238.06
IUPAC Name5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESClc1cc(NC2CCOC2)n2nccc2n1
InChIInChI=1S/C10H11ClN4O/c11-8-5-10(13-7-2-4-16-6-7)15-9(14-8)1-3-12-15/h1,3,5,7,13H,2,4,6H2
InChIKeyNAADWJRMEWOKRU-UHFFFAOYSA-N
XLogP1.58
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.68
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 134795552) is 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine is Clc1cc(NC2CCOC2)n2nccc2n1.
What is the InChIKey of 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is NAADWJRMEWOKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O/c11-8-5-10(13-7-2-4-16-6-7)15-9(14-8)1-3-12-15/h1,3,5,7,13H,2,4,6H2.
What are the key properties of 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 238.68 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 5-chloro-N-(oxolan-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 134795552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).