N-(2-oxo-1-phenylpyrimidin-4-yl)formamide

C11H9N3O2 — CID 154650491

IUPACN-(2-oxo-1-phenylpyrimidin-4-yl)formamide
SMILESO=CNc1ccn(-c2ccccc2)c(=O)n1
InChIInChI=1S/C11H9N3O2/c15-8-12-10-6-7-14(11(16)13-10)9-4-2-1-3-5-9/h1-8H,(H,12,13,15,16)
InChIKeyDIQZZUJZBWQNCY-UHFFFAOYSA-N
MW215.21 g/mol
LogP0.80
Rot. Bonds3

About N-(2-oxo-1-phenylpyrimidin-4-yl)formamide

N-(2-oxo-1-phenylpyrimidin-4-yl)formamide (PubChem CID 154650491) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is N-(2-oxo-1-phenylpyrimidin-4-yl)formamide.

Molecular Properties

Compound NameN-(2-oxo-1-phenylpyrimidin-4-yl)formamide
PubChem CID154650491
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC NameN-(2-oxo-1-phenylpyrimidin-4-yl)formamide
SMILESO=CNc1ccn(-c2ccccc2)c(=O)n1
InChIInChI=1S/C11H9N3O2/c15-8-12-10-6-7-14(11(16)13-10)9-4-2-1-3-5-9/h1-8H,(H,12,13,15,16)
InChIKeyDIQZZUJZBWQNCY-UHFFFAOYSA-N
XLogP0.80
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-(2-oxo-1-phenylpyrimidin-4-yl)formamide 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

2-methyl-1-phenylpyrimidin-4-one
CID 589332
N-[1-[3-[2-[4-(1-aminoethyl)piperidin-1-yl]ethyl]phenyl]-2-oxopyrimidin-4-yl]formamide;2-amino-2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one
CID 154651877
N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)formamide
CID 131880242
4-chloro-2-oxo-1-phenylpyridine-3-carbaldehyde
CID 101460288
lithium;hydride;N-phenylformamide
CID 174281873
4-(2-amino-3-hydroxypropanoyl)-N-[1-(4-formylphenyl)-2-oxopyrimidin-4-yl]piperazine-1-carboxamide
CID 154651071
N-pyrazolo[1,5-a]pyridin-2-ylformamide
CID 87078686
[1-[4-[[1-(4-formylphenyl)-2-oxopyrimidin-4-yl]carbamoyl]piperazin-1-yl]-2-methyl-1-oxopropan-2-yl] carbamate
CID 175366229
3-methyl-1,5-diphenylpyrazolo[3,4-d]pyrimidin-6-one
CID 645041
N,2-dimethyl-1-phenylimidazol-4-amine
CID 23064547
3-methyl-1-phenylpyrimidine-2,4-dione
CID 14566646
4-(1-oxoisoquinolin-2-yl)benzaldehyde
CID 123457542

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1-phenylpyrimidin-4-yl)formamide?
The IUPAC name of N-(2-oxo-1-phenylpyrimidin-4-yl)formamide (CID 154650491) is N-(2-oxo-1-phenylpyrimidin-4-yl)formamide.
What is the SMILES notation for N-(2-oxo-1-phenylpyrimidin-4-yl)formamide?
The canonical SMILES for N-(2-oxo-1-phenylpyrimidin-4-yl)formamide is O=CNc1ccn(-c2ccccc2)c(=O)n1.
What is the InChIKey of N-(2-oxo-1-phenylpyrimidin-4-yl)formamide?
The InChIKey is DIQZZUJZBWQNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c15-8-12-10-6-7-14(11(16)13-10)9-4-2-1-3-5-9/h1-8H,(H,12,13,15,16).
What are the key properties of N-(2-oxo-1-phenylpyrimidin-4-yl)formamide?
N-(2-oxo-1-phenylpyrimidin-4-yl)formamide has a molecular weight of 215.21 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1-phenylpyrimidin-4-yl)formamide is sourced from PubChem (CID 154650491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).