6-prop-1-enyl-1H-pyrimidine-2,4-dione

C7H8N2O2 — CID 88977058

IUPAC6-prop-1-enyl-1H-pyrimidine-2,4-dione
SMILESCC=Cc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C7H8N2O2/c1-2-3-5-4-6(10)9-7(11)8-5/h2-4H,1H3,(H2,8,9,10,11)
InChIKeyNTVFCBKTBCRVOB-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.10
Rot. Bonds1

About 6-prop-1-enyl-1H-pyrimidine-2,4-dione

6-prop-1-enyl-1H-pyrimidine-2,4-dione (PubChem CID 88977058) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 6-prop-1-enyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-prop-1-enyl-1H-pyrimidine-2,4-dione
PubChem CID88977058
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name6-prop-1-enyl-1H-pyrimidine-2,4-dione
SMILESCC=Cc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C7H8N2O2/c1-2-3-5-4-6(10)9-7(11)8-5/h2-4H,1H3,(H2,8,9,10,11)
InChIKeyNTVFCBKTBCRVOB-UHFFFAOYSA-N
XLogP0.10
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-prop-1-enyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-prop-1-enyl-1H-pyrimidine-2,4-dione (CID 88977058) is 6-prop-1-enyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-prop-1-enyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-prop-1-enyl-1H-pyrimidine-2,4-dione is CC=Cc1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of 6-prop-1-enyl-1H-pyrimidine-2,4-dione?
The InChIKey is NTVFCBKTBCRVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-2-3-5-4-6(10)9-7(11)8-5/h2-4H,1H3,(H2,8,9,10,11).
What are the key properties of 6-prop-1-enyl-1H-pyrimidine-2,4-dione?
6-prop-1-enyl-1H-pyrimidine-2,4-dione has a molecular weight of 152.15 g/mol, XLogP of 0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-1-enyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 88977058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).