5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine

C12H15N5 — CID 80977225

IUPAC5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2cnccn2)n1
InChIInChI=1S/C12H15N5/c1-3-4-10-16-11(8(2)12(13)17-10)9-7-14-5-6-15-9/h5-7H,3-4H2,1-2H3,(H2,13,16,17)
InChIKeyNAQMNBBUSADCAY-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.78
Rot. Bonds3

About 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine

5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine (PubChem CID 80977225) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine
PubChem CID80977225
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2cnccn2)n1
InChIInChI=1S/C12H15N5/c1-3-4-10-16-11(8(2)12(13)17-10)9-7-14-5-6-15-9/h5-7H,3-4H2,1-2H3,(H2,13,16,17)
InChIKeyNAQMNBBUSADCAY-UHFFFAOYSA-N
XLogP1.78
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine?
The IUPAC name of 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine (CID 80977225) is 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine?
The canonical SMILES for 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine is CCCc1nc(N)c(C)c(-c2cnccn2)n1.
What is the InChIKey of 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine?
The InChIKey is NAQMNBBUSADCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-3-4-10-16-11(8(2)12(13)17-10)9-7-14-5-6-15-9/h5-7H,3-4H2,1-2H3,(H2,13,16,17).
What are the key properties of 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine?
5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine has a molecular weight of 229.29 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propyl-6-pyrazin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80977225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).