5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione

C11H10N2O3 — CID 90752094

IUPAC5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione
SMILESCn1c(=O)c(O)cn(-c2ccccc2)c1=O
InChIInChI=1S/C11H10N2O3/c1-12-10(15)9(14)7-13(11(12)16)8-5-3-2-4-6-8/h2-7,14H,1H3
InChIKeyVQSCNHKBJLSJQO-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.24
Rot. Bonds1

About 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione

5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione (PubChem CID 90752094) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione
PubChem CID90752094
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione
SMILESCn1c(=O)c(O)cn(-c2ccccc2)c1=O
InChIInChI=1S/C11H10N2O3/c1-12-10(15)9(14)7-13(11(12)16)8-5-3-2-4-6-8/h2-7,14H,1H3
InChIKeyVQSCNHKBJLSJQO-UHFFFAOYSA-N
XLogP0.24
TPSA64.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(dimethylamino)methyl]-3-methyl-1-phenylpyrimidine-2,4-dione
CID 3041132
N-benzyl-3-methyl-2,4-dioxo-1-phenylpyrimidine-5-carboxamide
CID 14444896
1,3-dimethyl-5-phenyl-1,3,5-triazinane-2,4,6-trione
CID 15555687
3-methyl-1-phenylpyrimidine-2,4-dione
CID 14566646
5-hydroxy-1,3,8-trimethyl-6-phenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 54679227
6-(2-hydroxyphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione
CID 807088
9-(2,3-dihydroxyphenyl)-4,5,12,14-tetramethyl-8-phenyl-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2(7),3,5,10,16-pentaene-13,15-dione
CID 123945730
4-hydroxy-1,5-dimethyl-3-phenylimidazol-2-one
CID 13382230
2-methyl-4-phenyl-1,2,4-triazol-3-one
CID 68573802
6-benzyl-5-hydroxy-1,3-dimethyl-8H-pyrido[2,3-d]pyrimidine-2,4,7-trione
CID 54696224
4,6-dimethyl-12,14-diphenyl-2,4,6,12,14-pentazatricyclo[8.4.0.03,8]tetradeca-1(10),2,8-triene-5,7,11,13-tetrone
CID 14042826
4-(1,3-dimethyl-2,4-dioxo-5-phenylpyrrolo[3,4-d]pyrimidin-6-yl)benzoic acid
CID 1204961

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione?
The IUPAC name of 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione (CID 90752094) is 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione.
What is the SMILES notation for 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione?
The canonical SMILES for 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione is Cn1c(=O)c(O)cn(-c2ccccc2)c1=O.
What is the InChIKey of 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione?
The InChIKey is VQSCNHKBJLSJQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-12-10(15)9(14)7-13(11(12)16)8-5-3-2-4-6-8/h2-7,14H,1H3.
What are the key properties of 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione?
5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione has a molecular weight of 218.21 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-methyl-1-phenylpyrimidine-2,4-dione is sourced from PubChem (CID 90752094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).