5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione

C7H8N2O2 — CID 14914593

IUPAC5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione
SMILESC/C=C\c1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H8N2O2/c1-2-3-5-4-8-7(11)9-6(5)10/h2-4H,1H3,(H2,8,9,10,11)/b3-2-
InChIKeyPPTBYVVCEZHLQZ-IHWYPQMZSA-N
MW152.15 g/mol
LogP0.10
Rot. Bonds1

About 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione

5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione (PubChem CID 14914593) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione
PubChem CID14914593
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione
SMILESC/C=C\c1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H8N2O2/c1-2-3-5-4-8-7(11)9-6(5)10/h2-4H,1H3,(H2,8,9,10,11)/b3-2-
InChIKeyPPTBYVVCEZHLQZ-IHWYPQMZSA-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 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione (CID 14914593) is 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione is C/C=C\c1c[nH]c(=O)[nH]c1=O.
What is the InChIKey of 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione?
The InChIKey is PPTBYVVCEZHLQZ-IHWYPQMZSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-2-3-5-4-8-7(11)9-6(5)10/h2-4H,1H3,(H2,8,9,10,11)/b3-2-.
What are the key properties of 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione?
5-[(Z)-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 5-[(Z)-prop-1-enyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 14914593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).