1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione

C15H23N5O3 — CID 56796823

IUPAC1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
SMILESCn1c(CN2CCC(N3CCNC3=O)CC2)cc(=O)n(C)c1=O
InChIInChI=1S/C15H23N5O3/c1-17-12(9-13(21)18(2)15(17)23)10-19-6-3-11(4-7-19)20-8-5-16-14(20)22/h9,11H,3-8,10H2,1-2H3,(H,16,22)
InChIKeyLMKBLCCSSISFBT-UHFFFAOYSA-N
MW321.38 g/mol
LogP-0.93
Rot. Bonds3

About 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione

1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione (PubChem CID 56796823) has the molecular formula C15H23N5O3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
PubChem CID56796823
Molecular FormulaC15H23N5O3
Molecular Weight321.38 g/mol
Exact Mass321.18
IUPAC Name1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
SMILESCn1c(CN2CCC(N3CCNC3=O)CC2)cc(=O)n(C)c1=O
InChIInChI=1S/C15H23N5O3/c1-17-12(9-13(21)18(2)15(17)23)10-19-6-3-11(4-7-19)20-8-5-16-14(20)22/h9,11H,3-8,10H2,1-2H3,(H,16,22)
InChIKeyLMKBLCCSSISFBT-UHFFFAOYSA-N
XLogP-0.93
TPSA79.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 5-0.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione with MolForge

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Related Compounds

6-[(3R)-3-aminopiperidin-1-yl]-1-but-2-ynyl-3-methylpyrimidine-2,4-dione
CID 72707535
1,3-Dimethyl-6-(2-piperidin-1-ylethylamino)pyrimidine-2,4-dione
CID 657656
1,3-Dimethyl-6-[[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
CID 56821553
6-[(3R)-3-aminopiperidin-1-yl]-1-but-2-ynyl-3-ethylpyrimidine-2,4-dione
CID 145962833
6-[[(2R)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-1H-pyrimidine-2,4-dione
CID 172433754
6-(3-Aminopyrrolidin-1-yl)-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione dihydrochloride
CID 132343958
6-(3-Aminopiperidin-1-yl)-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione hydrochloride
CID 132372620
6-(4-Aminopiperidin-1-yl)-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione dihydrochloride
CID 137951228
6-[(3R)-3-aminopyrrolidin-1-yl]-3-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione hydrochloride
CID 145867708
N-{1-[2-(4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl)ethyl]pyrrolidin-3-yl}acetamide
CID 91838023
6-(3-aminopiperidino)-3-methyl-2,4(1H,3H)-pyrimidinedione
CID 56770224
6-(piperidin-1-ylmethyl)-1H-pyrimidine-2,4-dione
CID 22618062

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione (CID 56796823) is 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione is Cn1c(CN2CCC(N3CCNC3=O)CC2)cc(=O)n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione?
The InChIKey is LMKBLCCSSISFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O3/c1-17-12(9-13(21)18(2)15(17)23)10-19-6-3-11(4-7-19)20-8-5-16-14(20)22/h9,11H,3-8,10H2,1-2H3,(H,16,22).
What are the key properties of 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione?
1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione has a molecular weight of 321.38 g/mol, XLogP of -0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione is sourced from PubChem (CID 56796823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).