6-amino-1-phenylpyrimidine-2,4-dione

C10H9N3O2 — CID 702878

IUPAC6-amino-1-phenylpyrimidine-2,4-dione
SMILESNc1cc(=O)[nH]c(=O)n1-c1ccccc1
InChIInChI=1S/C10H9N3O2/c11-8-6-9(14)12-10(15)13(8)7-4-2-1-3-5-7/h1-6H,11H2,(H,12,14,15)
InChIKeyOSEUDSKXNZLSRV-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.11
Rot. Bonds1

About 6-amino-1-phenylpyrimidine-2,4-dione

6-amino-1-phenylpyrimidine-2,4-dione (PubChem CID 702878) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 6-amino-1-phenylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-phenylpyrimidine-2,4-dione
PubChem CID702878
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name6-amino-1-phenylpyrimidine-2,4-dione
SMILESNc1cc(=O)[nH]c(=O)n1-c1ccccc1
InChIInChI=1S/C10H9N3O2/c11-8-6-9(14)12-10(15)13(8)7-4-2-1-3-5-7/h1-6H,11H2,(H,12,14,15)
InChIKeyOSEUDSKXNZLSRV-UHFFFAOYSA-N
XLogP0.11
TPSA80.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-phenylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-phenylpyrimidine-2,4-dione (CID 702878) is 6-amino-1-phenylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-phenylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-phenylpyrimidine-2,4-dione is Nc1cc(=O)[nH]c(=O)n1-c1ccccc1.
What is the InChIKey of 6-amino-1-phenylpyrimidine-2,4-dione?
The InChIKey is OSEUDSKXNZLSRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c11-8-6-9(14)12-10(15)13(8)7-4-2-1-3-5-7/h1-6H,11H2,(H,12,14,15).
What are the key properties of 6-amino-1-phenylpyrimidine-2,4-dione?
6-amino-1-phenylpyrimidine-2,4-dione has a molecular weight of 203.20 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-phenylpyrimidine-2,4-dione is sourced from PubChem (CID 702878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).