2-amino-3,5,6-trimethylpyrimidin-4-one

C7H11N3O — CID 2822937

IUPAC2-amino-3,5,6-trimethylpyrimidin-4-one
SMILESCc1nc(N)n(C)c(=O)c1C
InChIInChI=1S/C7H11N3O/c1-4-5(2)9-7(8)10(3)6(4)11/h1-3H3,(H2,8,9)
InChIKeyLFEKYWCIYUZCHO-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.02
Rot. Bonds

About 2-amino-3,5,6-trimethylpyrimidin-4-one

2-amino-3,5,6-trimethylpyrimidin-4-one (PubChem CID 2822937) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-amino-3,5,6-trimethylpyrimidin-4-one.

Molecular Properties

Compound Name2-amino-3,5,6-trimethylpyrimidin-4-one
PubChem CID2822937
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name2-amino-3,5,6-trimethylpyrimidin-4-one
SMILESCc1nc(N)n(C)c(=O)c1C
InChIInChI=1S/C7H11N3O/c1-4-5(2)9-7(8)10(3)6(4)11/h1-3H3,(H2,8,9)
InChIKeyLFEKYWCIYUZCHO-UHFFFAOYSA-N
XLogP-0.02
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3,5,6-trimethylpyrimidin-4-one?
The IUPAC name of 2-amino-3,5,6-trimethylpyrimidin-4-one (CID 2822937) is 2-amino-3,5,6-trimethylpyrimidin-4-one.
What is the SMILES notation for 2-amino-3,5,6-trimethylpyrimidin-4-one?
The canonical SMILES for 2-amino-3,5,6-trimethylpyrimidin-4-one is Cc1nc(N)n(C)c(=O)c1C.
What is the InChIKey of 2-amino-3,5,6-trimethylpyrimidin-4-one?
The InChIKey is LFEKYWCIYUZCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-4-5(2)9-7(8)10(3)6(4)11/h1-3H3,(H2,8,9).
What are the key properties of 2-amino-3,5,6-trimethylpyrimidin-4-one?
2-amino-3,5,6-trimethylpyrimidin-4-one has a molecular weight of 153.18 g/mol, XLogP of -0.02, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,5,6-trimethylpyrimidin-4-one is sourced from PubChem (CID 2822937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).