1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione

C16H20N4O4 — CID 97281647

IUPAC1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione
SMILESCc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n(C)c(=O)n2C)no1
InChIInChI=1S/C16H20N4O4/c1-10-8-11(17-24-10)12-6-4-5-7-20(12)15(22)13-9-14(21)19(3)16(23)18(13)2/h8-9,12H,4-7H2,1-3H3/t12-/m1/s1
InChIKeyAXXVCFZVWHIMHN-GFCCVEGCSA-N
MW332.36 g/mol
LogP0.75
Rot. Bonds2

About 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione

1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione (PubChem CID 97281647) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione
PubChem CID97281647
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione
SMILESCc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n(C)c(=O)n2C)no1
InChIInChI=1S/C16H20N4O4/c1-10-8-11(17-24-10)12-6-4-5-7-20(12)15(22)13-9-14(21)19(3)16(23)18(13)2/h8-9,12H,4-7H2,1-3H3/t12-/m1/s1
InChIKeyAXXVCFZVWHIMHN-GFCCVEGCSA-N
XLogP0.75
TPSA90.34 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione with MolForge

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Related Compounds

(4,5-dichloro-1-methylpyrrol-2-yl)-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 56808405
cyclopentyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 53017082
1,3-dimethyl-6-[2-(4-methyl-1H-pyrazol-5-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione
CID 127247346
cyclohexyl-[(2S)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 94002505
cyclohexyl-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 94002506
[(2R)-2-(5-methyl-1,2-oxazol-3-yl)azepan-1-yl]-pyridin-4-ylmethanone
CID 92553808
[2-(5-methyl-1,2-oxazol-3-yl)azepan-1-yl]-pyridin-3-ylmethanone
CID 110225920
N-tert-butyl-4-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carbonyl]benzamide
CID 52513124
[(2S)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1-propan-2-ylpiperidin-4-yl)methanone
CID 97277737
2-ethoxy-1-[2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]ethanone
CID 91760961
(4-chloro-1-methylpyrazol-3-yl)-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 22586624
2-butyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carbonyl]pyridazin-3-one
CID 94002531

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione (CID 97281647) is 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione is Cc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n(C)c(=O)n2C)no1.
What is the InChIKey of 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione?
The InChIKey is AXXVCFZVWHIMHN-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-10-8-11(17-24-10)12-6-4-5-7-20(12)15(22)13-9-14(21)19(3)16(23)18(13)2/h8-9,12H,4-7H2,1-3H3/t12-/m1/s1.
What are the key properties of 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione?
1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione has a molecular weight of 332.36 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carbonyl]pyrimidine-2,4-dione is sourced from PubChem (CID 97281647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).