6-amino-1-phenylpyrimidin-2-one

C10H9N3O — CID 18444834

IUPAC6-amino-1-phenylpyrimidin-2-one
SMILESNc1ccnc(=O)n1-c1ccccc1
InChIInChI=1S/C10H9N3O/c11-9-6-7-12-10(14)13(9)8-4-2-1-3-5-8/h1-7H,11H2
InChIKeyNQFQHGGQNQONES-UHFFFAOYSA-N
MW187.20 g/mol
LogP0.81
Rot. Bonds1

About 6-amino-1-phenylpyrimidin-2-one

6-amino-1-phenylpyrimidin-2-one (PubChem CID 18444834) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is 6-amino-1-phenylpyrimidin-2-one.

Molecular Properties

Compound Name6-amino-1-phenylpyrimidin-2-one
PubChem CID18444834
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name6-amino-1-phenylpyrimidin-2-one
SMILESNc1ccnc(=O)n1-c1ccccc1
InChIInChI=1S/C10H9N3O/c11-9-6-7-12-10(14)13(9)8-4-2-1-3-5-8/h1-7H,11H2
InChIKeyNQFQHGGQNQONES-UHFFFAOYSA-N
XLogP0.81
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-amino-1-phenylpyrimidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-phenylpyrimidin-2-one?
The IUPAC name of 6-amino-1-phenylpyrimidin-2-one (CID 18444834) is 6-amino-1-phenylpyrimidin-2-one.
What is the SMILES notation for 6-amino-1-phenylpyrimidin-2-one?
The canonical SMILES for 6-amino-1-phenylpyrimidin-2-one is Nc1ccnc(=O)n1-c1ccccc1.
What is the InChIKey of 6-amino-1-phenylpyrimidin-2-one?
The InChIKey is NQFQHGGQNQONES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c11-9-6-7-12-10(14)13(9)8-4-2-1-3-5-8/h1-7H,11H2.
What are the key properties of 6-amino-1-phenylpyrimidin-2-one?
6-amino-1-phenylpyrimidin-2-one has a molecular weight of 187.20 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-phenylpyrimidin-2-one is sourced from PubChem (CID 18444834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).