1-phenyl-3-phenylmethoxypyrimidine-2,4-dione

C17H14N2O3 — CID 54281006

IUPAC1-phenyl-3-phenylmethoxypyrimidine-2,4-dione
SMILESO=c1ccn(-c2ccccc2)c(=O)n1OCc1ccccc1
InChIInChI=1S/C17H14N2O3/c20-16-11-12-18(15-9-5-2-6-10-15)17(21)19(16)22-13-14-7-3-1-4-8-14/h1-12H,13H2
InChIKeyRQUAHIRZQAGUDF-UHFFFAOYSA-N
MW294.31 g/mol
LogP1.63
Rot. Bonds4

About 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione

1-phenyl-3-phenylmethoxypyrimidine-2,4-dione (PubChem CID 54281006) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione.

Molecular Properties

Compound Name1-phenyl-3-phenylmethoxypyrimidine-2,4-dione
PubChem CID54281006
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name1-phenyl-3-phenylmethoxypyrimidine-2,4-dione
SMILESO=c1ccn(-c2ccccc2)c(=O)n1OCc1ccccc1
InChIInChI=1S/C17H14N2O3/c20-16-11-12-18(15-9-5-2-6-10-15)17(21)19(16)22-13-14-7-3-1-4-8-14/h1-12H,13H2
InChIKeyRQUAHIRZQAGUDF-UHFFFAOYSA-N
XLogP1.63
TPSA53.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-phenylpyrimidine-2,4-dione
CID 14566646
3-fluoro-1-phenylmethoxypyrimidine-2,4-dione
CID 54119422
1-(4-bromophenyl)-4-phenylmethoxypyridin-2-one
CID 59187025
1-phenylmethoxypyrazin-2-one
CID 685465
4-(hydroxymethyl)-1-phenylpyridin-2-one
CID 18698767
1-phenyl-6-phenylmethoxyindole
CID 22049132
6-(2,6-dioxo-3-phenylpyrimidin-1-yl)hexyl 2-methylpropanoate
CID 169034373
4-phenylmethoxy-1-[4-(propylamino)phenyl]pyridin-2-one
CID 24780169
bis(benzylperoxy)-oxophosphanium
CID 22644121
5-bromo-1-phenylmethoxypyrrolidin-2-one
CID 22495511
6-(ethylamino)-3-phenylmethoxy-1H-pyrimidine-2,4-dione
CID 134207868
(3S,4R)-3,4-dimethyl-1-phenylmethoxyazetidin-2-one
CID 10104396

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione?
The IUPAC name of 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione (CID 54281006) is 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione.
What is the SMILES notation for 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione?
The canonical SMILES for 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione is O=c1ccn(-c2ccccc2)c(=O)n1OCc1ccccc1.
What is the InChIKey of 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione?
The InChIKey is RQUAHIRZQAGUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c20-16-11-12-18(15-9-5-2-6-10-15)17(21)19(16)22-13-14-7-3-1-4-8-14/h1-12H,13H2.
What are the key properties of 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione?
1-phenyl-3-phenylmethoxypyrimidine-2,4-dione has a molecular weight of 294.31 g/mol, XLogP of 1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-phenylmethoxypyrimidine-2,4-dione is sourced from PubChem (CID 54281006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).