4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine

C13H18N6 — CID 171446119

IUPAC4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cc(N2CCn3cncc3C2)nc(N)n1
InChIInChI=1S/C13H18N6/c1-9(2)11-5-12(17-13(14)16-11)18-3-4-19-8-15-6-10(19)7-18/h5-6,8-9H,3-4,7H2,1-2H3,(H2,14,16,17)
InChIKeyVWYHRSYAYUKJMM-UHFFFAOYSA-N
MW258.33 g/mol
LogP1.40
Rot. Bonds2

About 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine

4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine (PubChem CID 171446119) has the molecular formula C13H18N6 and a molecular weight of 258.33 g/mol. Its IUPAC name is 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine
PubChem CID171446119
Molecular FormulaC13H18N6
Molecular Weight258.33 g/mol
Exact Mass258.16
IUPAC Name4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine
SMILESCC(C)c1cc(N2CCn3cncc3C2)nc(N)n1
InChIInChI=1S/C13H18N6/c1-9(2)11-5-12(17-13(14)16-11)18-3-4-19-8-15-6-10(19)7-18/h5-6,8-9H,3-4,7H2,1-2H3,(H2,14,16,17)
InChIKeyVWYHRSYAYUKJMM-UHFFFAOYSA-N
XLogP1.40
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.33
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine?
The IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine (CID 171446119) is 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine is CC(C)c1cc(N2CCn3cncc3C2)nc(N)n1.
What is the InChIKey of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine?
The InChIKey is VWYHRSYAYUKJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6/c1-9(2)11-5-12(17-13(14)16-11)18-3-4-19-8-15-6-10(19)7-18/h5-6,8-9H,3-4,7H2,1-2H3,(H2,14,16,17).
What are the key properties of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine?
4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine has a molecular weight of 258.33 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 171446119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).