N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine

C14H19N5 — CID 115372708

IUPACN-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESc1cc2nc(NC3CCNC4(CCC4)C3)ccn2n1
InChIInChI=1S/C14H19N5/c1-5-14(6-1)10-11(2-7-15-14)17-12-4-9-19-13(18-12)3-8-16-19/h3-4,8-9,11,15H,1-2,5-7,10H2,(H,17,18)
InChIKeyDEDVETCENMYANQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.82
Rot. Bonds2

About N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine

N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 115372708) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID115372708
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESc1cc2nc(NC3CCNC4(CCC4)C3)ccn2n1
InChIInChI=1S/C14H19N5/c1-5-14(6-1)10-11(2-7-15-14)17-12-4-9-19-13(18-12)3-8-16-19/h3-4,8-9,11,15H,1-2,5-7,10H2,(H,17,18)
InChIKeyDEDVETCENMYANQ-UHFFFAOYSA-N
XLogP1.82
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine (CID 115372708) is N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine is c1cc2nc(NC3CCNC4(CCC4)C3)ccn2n1.
What is the InChIKey of N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is DEDVETCENMYANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-5-14(6-1)10-11(2-7-15-14)17-12-4-9-19-13(18-12)3-8-16-19/h3-4,8-9,11,15H,1-2,5-7,10H2,(H,17,18).
What are the key properties of N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine?
N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 257.34 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azaspiro[3.5]nonan-8-yl)pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 115372708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).