5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide

C15H14FN3O3 — CID 10804375

IUPAC5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)n1cc(F)c(=O)[nH]c1=O
InChIInChI=1S/C15H14FN3O3/c16-12-8-19(15(22)18-13(12)20)14(21)17-11-6-5-9-3-1-2-4-10(9)7-11/h1-4,8,11H,5-7H2,(H,17,21)(H,18,20,22)
InChIKeyNVNDRUVZNUABPH-UHFFFAOYSA-N
MW303.29 g/mol
LogP0.79
Rot. Bonds1

About 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide

5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide (PubChem CID 10804375) has the molecular formula C15H14FN3O3 and a molecular weight of 303.29 g/mol. Its IUPAC name is 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide.

Molecular Properties

Compound Name5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide
PubChem CID10804375
Molecular FormulaC15H14FN3O3
Molecular Weight303.29 g/mol
Exact Mass303.10
IUPAC Name5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)n1cc(F)c(=O)[nH]c1=O
InChIInChI=1S/C15H14FN3O3/c16-12-8-19(15(22)18-13(12)20)14(21)17-11-6-5-9-3-1-2-4-10(9)7-11/h1-4,8,11H,5-7H2,(H,17,21)(H,18,20,22)
InChIKeyNVNDRUVZNUABPH-UHFFFAOYSA-N
XLogP0.79
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.29
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide 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-cyclohex-3-en-1-yl-5-fluoro-2,4-dioxopyrimidine-1-carboxamide
CID 10729535
2,6-difluoro-N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
CID 95271360
2,6-difluoro-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
CID 95271362
4-(4-hydroxyphenyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazine-1-carboxamide
CID 122568385
N-(1,2,3,4-tetrahydronaphthalen-2-yl)morpholine-4-carboxamide
CID 115599477
3-(1,2,3,4-tetrahydronaphthalen-2-ylcarbamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 62317267
N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-N'-(3,4,5-trifluorophenyl)oxamide
CID 95776233
2-chloro-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 11775776
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide
CID 68917081
1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
CID 115573941
5-(4-hydroxyphenyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolidine-3-carboxamide
CID 134080246
N-(1-adamantyl)-5-fluoro-2,4-dioxopyrimidine-1-carboxamide
CID 20525056

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide?
The IUPAC name of 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide (CID 10804375) is 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide.
What is the SMILES notation for 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide?
The canonical SMILES for 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide is O=C(NC1CCc2ccccc2C1)n1cc(F)c(=O)[nH]c1=O.
What is the InChIKey of 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide?
The InChIKey is NVNDRUVZNUABPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O3/c16-12-8-19(15(22)18-13(12)20)14(21)17-11-6-5-9-3-1-2-4-10(9)7-11/h1-4,8,11H,5-7H2,(H,17,21)(H,18,20,22).
What are the key properties of 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide?
5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide has a molecular weight of 303.29 g/mol, XLogP of 0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,4-dioxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidine-1-carboxamide is sourced from PubChem (CID 10804375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).