N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide

C11H8FN3O2 — CID 78180948

IUPACN-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide
SMILESO=C1N=CC(F)C(NC(=O)c2ccccc2)=N1
InChIInChI=1S/C11H8FN3O2/c12-8-6-13-11(17)15-9(8)14-10(16)7-4-2-1-3-5-7/h1-6,8H,(H,14,15,16,17)
InChIKeyWNVSVFQDNDJZIH-UHFFFAOYSA-N
MW233.20 g/mol
LogP1.36
Rot. Bonds1

About N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide

N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide (PubChem CID 78180948) has the molecular formula C11H8FN3O2 and a molecular weight of 233.20 g/mol. Its IUPAC name is N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide.

Molecular Properties

Compound NameN-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide
PubChem CID78180948
Molecular FormulaC11H8FN3O2
Molecular Weight233.20 g/mol
Exact Mass233.06
IUPAC NameN-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide
SMILESO=C1N=CC(F)C(NC(=O)c2ccccc2)=N1
InChIInChI=1S/C11H8FN3O2/c12-8-6-13-11(17)15-9(8)14-10(16)7-4-2-1-3-5-7/h1-6,8H,(H,14,15,16,17)
InChIKeyWNVSVFQDNDJZIH-UHFFFAOYSA-N
XLogP1.36
TPSA70.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.20
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide 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

N-pyrimidin-2-ylbenzamide
CID 638481
N-(5-oxo-1,4-dihydroimidazol-2-yl)benzamide
CID 47266240
N-(5-fluoro-1H-1,2,4-triazol-3-yl)benzamide
CID 174732439
molecular hydrogen;N-phenylbenzamide
CID 145238042
N-(1H-pyrazol-5-yl)benzamide
CID 23298723
N-[2-(methylamino)phenyl]benzamide
CID 101444547
N-pyrimidin-2-ylbenzamide;silver
CID 175574792
3,5-dibenzamido-N-phenylbenzamide
CID 17340966
N-[(5R)-6-oxo-1,5-dihydropurin-2-yl]benzamide
CID 135890218
N-tribenzamidosilylbenzamide
CID 175170799
4-benzoyl-N-(4-fluorophenyl)benzamide
CID 2315903
N-[4-(2-benzamido-1,3-thiazol-4-yl)-1,3-thiazol-2-yl]benzamide
CID 4294892

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide?
The IUPAC name of N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide (CID 78180948) is N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide.
What is the SMILES notation for N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide?
The canonical SMILES for N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide is O=C1N=CC(F)C(NC(=O)c2ccccc2)=N1.
What is the InChIKey of N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide?
The InChIKey is WNVSVFQDNDJZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O2/c12-8-6-13-11(17)15-9(8)14-10(16)7-4-2-1-3-5-7/h1-6,8H,(H,14,15,16,17).
What are the key properties of N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide?
N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide has a molecular weight of 233.20 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-oxo-5H-pyrimidin-4-yl)benzamide is sourced from PubChem (CID 78180948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).