1-prop-1-en-2-ylpyrimidine-2,4-dione

C7H8N2O2 — CID 144698021

IUPAC1-prop-1-en-2-ylpyrimidine-2,4-dione
SMILESC=C(C)n1ccc(=O)[nH]c1=O
InChIInChI=1S/C7H8N2O2/c1-5(2)9-4-3-6(10)8-7(9)11/h3-4H,1H2,2H3,(H,8,10,11)
InChIKeyGPCSOLFVPBCFRU-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.03
Rot. Bonds1

About 1-prop-1-en-2-ylpyrimidine-2,4-dione

1-prop-1-en-2-ylpyrimidine-2,4-dione (PubChem CID 144698021) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 1-prop-1-en-2-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1-prop-1-en-2-ylpyrimidine-2,4-dione
PubChem CID144698021
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name1-prop-1-en-2-ylpyrimidine-2,4-dione
SMILESC=C(C)n1ccc(=O)[nH]c1=O
InChIInChI=1S/C7H8N2O2/c1-5(2)9-4-3-6(10)8-7(9)11/h3-4H,1H2,2H3,(H,8,10,11)
InChIKeyGPCSOLFVPBCFRU-UHFFFAOYSA-N
XLogP0.03
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-fluoroethenyl)pyrimidine-2,4-dione
CID 67743513
2,4-dioxopyrimidine-1-carboxylic acid;zinc
CID 174838815
2,4-dioxopyrimidine-1-carboxamide
CID 54056435
2-(2,4-dioxopyrimidin-1-yl)-2-oxoacetic acid
CID 66599108
1-[1-[(2R)-1,3-dihydroxybutan-2-yl]sulfanylethenyl]pyrimidine-2,4-dione
CID 163836372
(2,4-dioxopyrimidin-1-yl) acetate
CID 57007226
ethane;1-methylpyrimidine-2,4-dione
CID 91098384
N-(2,4-dioxopyrimidin-1-yl)acetamide
CID 11819433
sodium;(2,4-dioxopyrimidin-1-yl) acetate;hydride
CID 174402770
1-pent-4-ynoylpyrimidine-2,4-dione
CID 100999366
1-(5-bromopentanoyl)pyrimidine-2,4-dione
CID 125478537
1-[2-(bromomethyl)prop-2-enyl]pyrimidine-2,4-dione
CID 177313030

Frequently Asked Questions

What is the IUPAC name of 1-prop-1-en-2-ylpyrimidine-2,4-dione?
The IUPAC name of 1-prop-1-en-2-ylpyrimidine-2,4-dione (CID 144698021) is 1-prop-1-en-2-ylpyrimidine-2,4-dione.
What is the SMILES notation for 1-prop-1-en-2-ylpyrimidine-2,4-dione?
The canonical SMILES for 1-prop-1-en-2-ylpyrimidine-2,4-dione is C=C(C)n1ccc(=O)[nH]c1=O.
What is the InChIKey of 1-prop-1-en-2-ylpyrimidine-2,4-dione?
The InChIKey is GPCSOLFVPBCFRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-5(2)9-4-3-6(10)8-7(9)11/h3-4H,1H2,2H3,(H,8,10,11).
What are the key properties of 1-prop-1-en-2-ylpyrimidine-2,4-dione?
1-prop-1-en-2-ylpyrimidine-2,4-dione has a molecular weight of 152.15 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-1-en-2-ylpyrimidine-2,4-dione is sourced from PubChem (CID 144698021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).