5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine

C15H16N6O — CID 3232933

IUPAC5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(CNc2ncncc2-c2c(C)noc2C)cn1
InChIInChI=1S/C15H16N6O/c1-9-4-18-12(5-17-9)6-19-15-13(7-16-8-20-15)14-10(2)21-22-11(14)3/h4-5,7-8H,6H2,1-3H3,(H,16,19,20)
InChIKeyCPNWXQWPHJIOMN-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.46
Rot. Bonds4

About 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine

5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine (PubChem CID 3232933) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
PubChem CID3232933
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(CNc2ncncc2-c2c(C)noc2C)cn1
InChIInChI=1S/C15H16N6O/c1-9-4-18-12(5-17-9)6-19-15-13(7-16-8-20-15)14-10(2)21-22-11(14)3/h4-5,7-8H,6H2,1-3H3,(H,16,19,20)
InChIKeyCPNWXQWPHJIOMN-UHFFFAOYSA-N
XLogP2.46
TPSA89.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine (CID 3232933) is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine is Cc1cnc(CNc2ncncc2-c2c(C)noc2C)cn1.
What is the InChIKey of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is CPNWXQWPHJIOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-9-4-18-12(5-17-9)6-19-15-13(7-16-8-20-15)14-10(2)21-22-11(14)3/h4-5,7-8H,6H2,1-3H3,(H,16,19,20).
What are the key properties of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine?
5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 296.33 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 3232933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).