5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione

C15H17N3O3 — CID 52944921

IUPAC5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione
SMILESCc1cn([C@@H]2C[C@H](c3ccccc3)N(C)O2)c(=O)[nH]c1=O
InChIInChI=1S/C15H17N3O3/c1-10-9-18(15(20)16-14(10)19)13-8-12(17(2)21-13)11-6-4-3-5-7-11/h3-7,9,12-13H,8H2,1-2H3,(H,16,19,20)/t12-,13+/m1/s1
InChIKeyQVHOFEHYYFKZBC-OLZOCXBDSA-N
MW287.32 g/mol
LogP1.35
Rot. Bonds2

About 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione

5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione (PubChem CID 52944921) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione
PubChem CID52944921
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione
SMILESCc1cn([C@@H]2C[C@H](c3ccccc3)N(C)O2)c(=O)[nH]c1=O
InChIInChI=1S/C15H17N3O3/c1-10-9-18(15(20)16-14(10)19)13-8-12(17(2)21-13)11-6-4-3-5-7-11/h3-7,9,12-13H,8H2,1-2H3,(H,16,19,20)/t12-,13+/m1/s1
InChIKeyQVHOFEHYYFKZBC-OLZOCXBDSA-N
XLogP1.35
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione with MolForge

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Related Compounds

1-[(3S,5R)-2-benzyl-3-pyridin-3-yl-1,2-oxazolidin-5-yl]-5-methylpyrimidine-2,4-dione
CID 102129284
1-[(3R,5S)-2-tert-butyl-3-phenyl-1,2-oxazolidin-5-yl]-5-fluoropyrimidine-2,4-dione
CID 52946183
1-[(3R,5S)-2-benzyl-3-naphthalen-1-yl-1,2-oxazolidin-5-yl]-5-methylpyrimidine-2,4-dione
CID 78319332
5-methyl-1-[(2R,4R)-4-phenylmethoxyoxolan-2-yl]pyrimidine-2,4-dione
CID 54768279
diethyl [(3R,5S)-2-methyl-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-1,2-oxazolidin-3-yl]methyl phosphate
CID 11199760
1-[(2R,4S,5S)-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 1277936
1-[(2R)-4,5-dihydroxyoxan-2-yl]-5-methylpyrimidine-2,4-dione
CID 25134798
1-[(2R,4S,5R)-4,5-dihydroxyoxan-2-yl]-5-methylpyrimidine-2,4-dione
CID 14079545
2-[(3R,5S)-3-methyl-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-1,2-oxazolidin-2-yl]ethyl acetate
CID 10637734
1-[(2S,5R)-5-(hydroxymethyl)-5-phenyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 102285706
1-[(2S,5aR,7R,8aR)-3-ethoxy-3-oxo-2-phenyl-2,5,5a,7,8,8a-hexahydrofuro[3,2-e][1,4,2]dioxaphosphepin-7-yl]-5-methylpyrimidine-2,4-dione
CID 101454848
2-[(2S,3R,5R)-2-[(1,3-dioxoisoindol-2-yl)methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]acetic acid
CID 101219328

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione?
The IUPAC name of 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione (CID 52944921) is 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione is Cc1cn([C@@H]2C[C@H](c3ccccc3)N(C)O2)c(=O)[nH]c1=O.
What is the InChIKey of 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione?
The InChIKey is QVHOFEHYYFKZBC-OLZOCXBDSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-9-18(15(20)16-14(10)19)13-8-12(17(2)21-13)11-6-4-3-5-7-11/h3-7,9,12-13H,8H2,1-2H3,(H,16,19,20)/t12-,13+/m1/s1.
What are the key properties of 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione?
5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione has a molecular weight of 287.32 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[(3R,5S)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]pyrimidine-2,4-dione is sourced from PubChem (CID 52944921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).