6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione

C16H23N5O4 — CID 56800023

IUPAC6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C16H23N5O4/c1-10-12(14(23)19-15(24)18-10)4-5-13(22)20-7-2-3-11(9-20)21-8-6-17-16(21)25/h11H,2-9H2,1H3,(H,17,25)(H2,18,19,23,24)
InChIKeyKGSPUKVVPCAZLM-UHFFFAOYSA-N
MW349.39 g/mol
LogP-0.68
Rot. Bonds4

About 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione

6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione (PubChem CID 56800023) has the molecular formula C16H23N5O4 and a molecular weight of 349.39 g/mol. Its IUPAC name is 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione
PubChem CID56800023
Molecular FormulaC16H23N5O4
Molecular Weight349.39 g/mol
Exact Mass349.18
IUPAC Name6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C16H23N5O4/c1-10-12(14(23)19-15(24)18-10)4-5-13(22)20-7-2-3-11(9-20)21-8-6-17-16(21)25/h11H,2-9H2,1H3,(H,17,25)(H2,18,19,23,24)
InChIKeyKGSPUKVVPCAZLM-UHFFFAOYSA-N
XLogP-0.68
TPSA118.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 5-0.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione (CID 56800023) is 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione is Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N1CCCC(N2CCNC2=O)C1.
What is the InChIKey of 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione?
The InChIKey is KGSPUKVVPCAZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O4/c1-10-12(14(23)19-15(24)18-10)4-5-13(22)20-7-2-3-11(9-20)21-8-6-17-16(21)25/h11H,2-9H2,1H3,(H,17,25)(H2,18,19,23,24).
What are the key properties of 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione?
6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione has a molecular weight of 349.39 g/mol, XLogP of -0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-[3-oxo-3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 56800023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).