6-amino-1,5-dimethylpyrimidine-2,4-dione

C6H9N3O2 — CID 5050734

IUPAC6-amino-1,5-dimethylpyrimidine-2,4-dione
SMILESCc1c(N)n(C)c(=O)[nH]c1=O
InChIInChI=1S/C6H9N3O2/c1-3-4(7)9(2)6(11)8-5(3)10/h7H2,1-2H3,(H,8,10,11)
InChIKeyOIZFMHOUKUBDHH-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.04
Rot. Bonds

About 6-amino-1,5-dimethylpyrimidine-2,4-dione

6-amino-1,5-dimethylpyrimidine-2,4-dione (PubChem CID 5050734) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 6-amino-1,5-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1,5-dimethylpyrimidine-2,4-dione
PubChem CID5050734
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name6-amino-1,5-dimethylpyrimidine-2,4-dione
SMILESCc1c(N)n(C)c(=O)[nH]c1=O
InChIInChI=1S/C6H9N3O2/c1-3-4(7)9(2)6(11)8-5(3)10/h7H2,1-2H3,(H,8,10,11)
InChIKeyOIZFMHOUKUBDHH-UHFFFAOYSA-N
XLogP-1.04
TPSA80.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1,5-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1,5-dimethylpyrimidine-2,4-dione (CID 5050734) is 6-amino-1,5-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1,5-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1,5-dimethylpyrimidine-2,4-dione is Cc1c(N)n(C)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1,5-dimethylpyrimidine-2,4-dione?
The InChIKey is OIZFMHOUKUBDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-3-4(7)9(2)6(11)8-5(3)10/h7H2,1-2H3,(H,8,10,11).
What are the key properties of 6-amino-1,5-dimethylpyrimidine-2,4-dione?
6-amino-1,5-dimethylpyrimidine-2,4-dione has a molecular weight of 155.16 g/mol, XLogP of -1.04, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1,5-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 5050734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).