6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione

C10H8FN3O2 — CID 2997260

IUPAC6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione
SMILESNc1cc(=O)[nH]c(=O)n1-c1ccccc1F
InChIInChI=1S/C10H8FN3O2/c11-6-3-1-2-4-7(6)14-8(12)5-9(15)13-10(14)16/h1-5H,12H2,(H,13,15,16)
InChIKeyUULFXQHUGLVQMA-UHFFFAOYSA-N
MW221.19 g/mol
LogP0.25
Rot. Bonds1

About 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione

6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione (PubChem CID 2997260) has the molecular formula C10H8FN3O2 and a molecular weight of 221.19 g/mol. Its IUPAC name is 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione
PubChem CID2997260
Molecular FormulaC10H8FN3O2
Molecular Weight221.19 g/mol
Exact Mass221.06
IUPAC Name6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione
SMILESNc1cc(=O)[nH]c(=O)n1-c1ccccc1F
InChIInChI=1S/C10H8FN3O2/c11-6-3-1-2-4-7(6)14-8(12)5-9(15)13-10(14)16/h1-5H,12H2,(H,13,15,16)
InChIKeyUULFXQHUGLVQMA-UHFFFAOYSA-N
XLogP0.25
TPSA80.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 7595
1,1-Dimethyl-3-(4-fluorophenyl)urea
CID 9514
4-Fluorophenylurea
CID 12612
N-(4-fluorophenyl)acetamide
CID 9601
N-(2-Fluorophenyl)acetamide
CID 67860
N-((Phenylamino)carbonyl)acetamide
CID 66877
1-Phenyl-1,3-diazinane-2,4-dione
CID 638639
1-(2-Fluorophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
CID 2274725
N-(4-fluorophenyl)prop-2-enamide
CID 3250203
N-(3-Fluorophenyl)-2-propenamide
CID 3440774
3-(2-Chloroacetyl)-1-phenylurea
CID 10976790
N-(3-Fluorophenyl)acetamide
CID 9594

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione (CID 2997260) is 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione is Nc1cc(=O)[nH]c(=O)n1-c1ccccc1F.
What is the InChIKey of 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione?
The InChIKey is UULFXQHUGLVQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O2/c11-6-3-1-2-4-7(6)14-8(12)5-9(15)13-10(14)16/h1-5H,12H2,(H,13,15,16).
What are the key properties of 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione?
6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione has a molecular weight of 221.19 g/mol, XLogP of 0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(2-fluorophenyl)pyrimidine-2,4-dione is sourced from PubChem (CID 2997260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).