2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine

C14H19N5O — CID 104516561

IUPAC2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(-c2nccnc2OC)nc(C(C)(C)C)n1
InChIInChI=1S/C14H19N5O/c1-14(2,3)13-18-9(8-10(15-4)19-13)11-12(20-5)17-7-6-16-11/h6-8H,1-5H3,(H,15,18,19)
InChIKeyHIEFMTRMGXZFKN-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.28
Rot. Bonds3

About 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine

2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine (PubChem CID 104516561) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine
PubChem CID104516561
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(-c2nccnc2OC)nc(C(C)(C)C)n1
InChIInChI=1S/C14H19N5O/c1-14(2,3)13-18-9(8-10(15-4)19-13)11-12(20-5)17-7-6-16-11/h6-8H,1-5H3,(H,15,18,19)
InChIKeyHIEFMTRMGXZFKN-UHFFFAOYSA-N
XLogP2.28
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine
CID 106769030
2-tert-butyl-N-methyl-6-(2-methylpyrazol-3-yl)pyrimidin-4-amine
CID 80952490
2,6-ditert-butyl-N-methylpyrimidin-4-amine
CID 62192327
2-tert-butyl-6-(3-chloro-4-methylphenyl)-N-methylpyrimidin-4-amine
CID 115504214
2-tert-butyl-N-methyl-6-propylpyrimidin-4-amine
CID 62192152
2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine
CID 63353528
2-tert-butyl-4-N-(2-methoxyphenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80956487
2-tert-butyl-6-(2,2-dimethylhydrazinyl)-N-methylpyrimidin-4-amine
CID 83024839
2-tert-butyl-4-N-(2-ethoxyethyl)-6-N-methylpyrimidine-4,6-diamine
CID 80966986
2-tert-butyl-N-methyl-6-(2-methylbutan-2-yloxy)pyrimidin-4-amine
CID 80966607
6-(3-methoxypyrazin-2-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 104516628
2-methoxy-3-pyridin-2-ylpyrazine
CID 91147636

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine (CID 104516561) is 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine is CNc1cc(-c2nccnc2OC)nc(C(C)(C)C)n1.
What is the InChIKey of 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine?
The InChIKey is HIEFMTRMGXZFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-14(2,3)13-18-9(8-10(15-4)19-13)11-12(20-5)17-7-6-16-11/h6-8H,1-5H3,(H,15,18,19).
What are the key properties of 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine?
2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 104516561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).