[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone

C15H18N6O — CID 110272179

IUPAC[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone
SMILESCc1cc(N)nc(C2(C)CCCN2C(=O)c2cnccn2)n1
InChIInChI=1S/C15H18N6O/c1-10-8-12(16)20-14(19-10)15(2)4-3-7-21(15)13(22)11-9-17-5-6-18-11/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,19,20)
InChIKeyJAOSWVPALHTZKJ-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.31
Rot. Bonds2

About [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone

[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone (PubChem CID 110272179) has the molecular formula C15H18N6O and a molecular weight of 298.35 g/mol. Its IUPAC name is [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone
PubChem CID110272179
Molecular FormulaC15H18N6O
Molecular Weight298.35 g/mol
Exact Mass298.15
IUPAC Name[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone
SMILESCc1cc(N)nc(C2(C)CCCN2C(=O)c2cnccn2)n1
InChIInChI=1S/C15H18N6O/c1-10-8-12(16)20-14(19-10)15(2)4-3-7-21(15)13(22)11-9-17-5-6-18-11/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,19,20)
InChIKeyJAOSWVPALHTZKJ-UHFFFAOYSA-N
XLogP1.31
TPSA97.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone?
The IUPAC name of [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone (CID 110272179) is [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone.
What is the SMILES notation for [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone?
The canonical SMILES for [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone is Cc1cc(N)nc(C2(C)CCCN2C(=O)c2cnccn2)n1.
What is the InChIKey of [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone?
The InChIKey is JAOSWVPALHTZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O/c1-10-8-12(16)20-14(19-10)15(2)4-3-7-21(15)13(22)11-9-17-5-6-18-11/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,19,20).
What are the key properties of [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone?
[2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone has a molecular weight of 298.35 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-amino-6-methylpyrimidin-2-yl)-2-methylpyrrolidin-1-yl]-pyrazin-2-ylmethanone is sourced from PubChem (CID 110272179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).