2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one

C10H8BrN3O — CID 135413497

💊View drug profile → bropirimine
IUPAC2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one
SMILESNc1nc(-c2ccccc2)c(Br)c(=O)[nH]1
InChIInChI=1S/C10H8BrN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15)
InChIKeyCIUUIPMOFZIWIZ-UHFFFAOYSA-N
MW266.10 g/mol
LogP1.78
Rot. Bonds1

About 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one

2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one (PubChem CID 135413497) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one
PubChem CID135413497
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one
SMILESNc1nc(-c2ccccc2)c(Br)c(=O)[nH]1
InChIInChI=1S/C10H8BrN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15)
InChIKeyCIUUIPMOFZIWIZ-UHFFFAOYSA-N
XLogP1.78
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one with MolForge

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

Launch Full Analysis

Related Compounds

6-Methyl-2-[(phenylmethyl)amino]-4(3H)-pyrimidinone
CID 135421723
4(1H)-Pyrimidinone, 2-amino-5-chloro-6-phenyl-
CID 135480622
2-Amino-6-oxo-4-phenyl-1,6-dihydropyrimidine-5-carbonitrile
CID 135724997
2-Imino-5-methyl-6-phenyl-1,2-dihydropyrimidin-4-ol
CID 135449835
2-Amino-6-(2-phenylethyl)pyrimidin-4(3h)-one
CID 135408658
2-Amino-5-bromo-6-(3-fluorophenyl)-4(3H)pyrimidinone
CID 135407143
2-amino-5-bromo-4-(4-fluorophenyl)-1H-pyrimidin-6-one
CID 135444024
2-Amino-6-phenylpyrimidin-4-ol
CID 135420365
6-Phenylpyrimidin-4-ol
CID 135418832
2-amino-4-[3-(trifluoromethyl)phenyl]-1H-pyrimidin-6-one
CID 136097004
2-(Methylamino)-6-phenylpyrimidin-4-ol
CID 135973621
2-Amino-6-(4-fluorophenyl)-5-iodo-4(3H)-pyrimidinone
CID 135453598

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one?
The IUPAC name of 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one (CID 135413497) is 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one is Nc1nc(-c2ccccc2)c(Br)c(=O)[nH]1.
What is the InChIKey of 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one?
The InChIKey is CIUUIPMOFZIWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15).
What are the key properties of 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one?
2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one has a molecular weight of 266.10 g/mol, XLogP of 1.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135413497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).