5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C15H22N4O — CID 70732923

IUPAC5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NC2CCOCC2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H22N4O/c1-4-12-9-14(16-13-5-7-20-8-6-13)19-15(17-12)10(2)11(3)18-19/h9,13,16H,4-8H2,1-3H3
InChIKeyNRZOKKCYQDJEIB-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.50
Rot. Bonds3

About 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 70732923) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID70732923
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NC2CCOCC2)n2nc(C)c(C)c2n1
InChIInChI=1S/C15H22N4O/c1-4-12-9-14(16-13-5-7-20-8-6-13)19-15(17-12)10(2)11(3)18-19/h9,13,16H,4-8H2,1-3H3
InChIKeyNRZOKKCYQDJEIB-UHFFFAOYSA-N
XLogP2.50
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 70732923) is 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(NC2CCOCC2)n2nc(C)c(C)c2n1.
What is the InChIKey of 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is NRZOKKCYQDJEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-4-12-9-14(16-13-5-7-20-8-6-13)19-15(17-12)10(2)11(3)18-19/h9,13,16H,4-8H2,1-3H3.
What are the key properties of 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 274.37 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,3-dimethyl-N-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 70732923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).