3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

C14H15N7O — CID 45486124

IUPAC3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cccnc2c1-c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C14H15N7O/c15-13-12(14-16-2-1-3-21(14)19-13)10-8-11(18-9-17-10)20-4-6-22-7-5-20/h1-3,8-9H,4-7H2,(H2,15,19)
InChIKeyQZKDVPFPVWQJIY-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.61
Rot. Bonds2

About 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (PubChem CID 45486124) has the molecular formula C14H15N7O and a molecular weight of 297.32 g/mol. Its IUPAC name is 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
PubChem CID45486124
Molecular FormulaC14H15N7O
Molecular Weight297.32 g/mol
Exact Mass297.13
IUPAC Name3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cccnc2c1-c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C14H15N7O/c15-13-12(14-16-2-1-3-21(14)19-13)10-8-11(18-9-17-10)20-4-6-22-7-5-20/h1-3,8-9H,4-7H2,(H2,15,19)
InChIKeyQZKDVPFPVWQJIY-UHFFFAOYSA-N
XLogP0.61
TPSA94.46 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (CID 45486124) is 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is Nc1nn2cccnc2c1-c1cc(N2CCOCC2)ncn1.
What is the InChIKey of 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is QZKDVPFPVWQJIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7O/c15-13-12(14-16-2-1-3-21(14)19-13)10-8-11(18-9-17-10)20-4-6-22-7-5-20/h1-3,8-9H,4-7H2,(H2,15,19).
What are the key properties of 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 297.32 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 45486124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).