6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine

C15H20N6O — CID 50981939

IUPAC6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(Cc1cnccn1)Nc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C15H20N6O/c1-12(8-13-10-16-2-3-17-13)20-14-9-15(19-11-18-14)21-4-6-22-7-5-21/h2-3,9-12H,4-8H2,1H3,(H,18,19,20)
InChIKeyWXTKEJPZPBMORC-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.15
Rot. Bonds5

About 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine

6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine (PubChem CID 50981939) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
PubChem CID50981939
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC Name6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(Cc1cnccn1)Nc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C15H20N6O/c1-12(8-13-10-16-2-3-17-13)20-14-9-15(19-11-18-14)21-4-6-22-7-5-21/h2-3,9-12H,4-8H2,1H3,(H,18,19,20)
InChIKeyWXTKEJPZPBMORC-UHFFFAOYSA-N
XLogP1.15
TPSA76.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine (CID 50981939) is 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine is CC(Cc1cnccn1)Nc1cc(N2CCOCC2)ncn1.
What is the InChIKey of 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is WXTKEJPZPBMORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-12(8-13-10-16-2-3-17-13)20-14-9-15(19-11-18-14)21-4-6-22-7-5-21/h2-3,9-12H,4-8H2,1H3,(H,18,19,20).
What are the key properties of 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 300.37 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 50981939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).