6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione

C15H18N2O4 — CID 104767898

IUPAC6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione
SMILESCC(C)OCCn1c(O)c(-c2ccccc2)c(=O)[nH]c1=O
InChIInChI=1S/C15H18N2O4/c1-10(2)21-9-8-17-14(19)12(13(18)16-15(17)20)11-6-4-3-5-7-11/h3-7,10,19H,8-9H2,1-2H3,(H,16,18,20)
InChIKeyXMOIPMSHRLJDEQ-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.33
Rot. Bonds5

About 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione

6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione (PubChem CID 104767898) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione
PubChem CID104767898
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione
SMILESCC(C)OCCn1c(O)c(-c2ccccc2)c(=O)[nH]c1=O
InChIInChI=1S/C15H18N2O4/c1-10(2)21-9-8-17-14(19)12(13(18)16-15(17)20)11-6-4-3-5-7-11/h3-7,10,19H,8-9H2,1-2H3,(H,16,18,20)
InChIKeyXMOIPMSHRLJDEQ-UHFFFAOYSA-N
XLogP1.33
TPSA84.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-hydroxy-1-(4-methylpentyl)-5-phenylpyrimidine-2,4-dione
CID 115948124
6-hydroxy-5-phenyl-1-(3,3,3-trifluoropropyl)pyrimidine-2,4-dione
CID 115948074
6-hydroxy-1-(2-methyl-3-methylsulfanylpropyl)-5-phenylpyrimidine-2,4-dione
CID 115948240
6-hydroxy-1-(3-methylbutan-2-yl)-5-phenylpyrimidine-2,4-dione
CID 115945962
1-(cyclopentylmethyl)-6-hydroxy-5-phenylpyrimidine-2,4-dione
CID 115946756
6-hydroxy-5-phenyl-1-(1,3-thiazol-2-ylmethyl)pyrimidine-2,4-dione
CID 115947290
5-(3-fluorophenyl)-6-hydroxy-1-(3-methoxypropyl)pyrimidine-2,4-dione
CID 115946665
5-fluoro-6-hydroxy-1-(4-propan-2-yloxybutyl)pyrimidine-2,4-dione
CID 106006125
6-hydroxy-5-propan-2-yl-1-(4-propan-2-yloxybutyl)pyrimidine-2,4-dione
CID 106006139
6-hydroxy-1-(3-methylbutyl)-5-(2-methylphenyl)pyrimidine-2,4-dione
CID 115946162
1-butyl-6-hydroxy-5-(3-methylphenyl)pyrimidine-2,4-dione
CID 115946137
5-(2-chlorophenyl)-6-hydroxy-1-(3-methylbutyl)pyrimidine-2,4-dione
CID 115946168

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione (CID 104767898) is 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione is CC(C)OCCn1c(O)c(-c2ccccc2)c(=O)[nH]c1=O.
What is the InChIKey of 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione?
The InChIKey is XMOIPMSHRLJDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-10(2)21-9-8-17-14(19)12(13(18)16-15(17)20)11-6-4-3-5-7-11/h3-7,10,19H,8-9H2,1-2H3,(H,16,18,20).
What are the key properties of 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione?
6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione has a molecular weight of 290.32 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5-phenyl-1-(2-propan-2-yloxyethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 104767898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).