5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione

C14H20N4O3 — CID 56880919

IUPAC5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione
SMILESO=C1CCCN1C1CCN(Cc2c[nH]c(=O)[nH]c2=O)CC1
InChIInChI=1S/C14H20N4O3/c19-12-2-1-5-18(12)11-3-6-17(7-4-11)9-10-8-15-14(21)16-13(10)20/h8,11H,1-7,9H2,(H2,15,16,20,21)
InChIKeyGNLARQCOWMYBBG-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.35
Rot. Bonds3

About 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione

5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione (PubChem CID 56880919) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione
PubChem CID56880919
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione
SMILESO=C1CCCN1C1CCN(Cc2c[nH]c(=O)[nH]c2=O)CC1
InChIInChI=1S/C14H20N4O3/c19-12-2-1-5-18(12)11-3-6-17(7-4-11)9-10-8-15-14(21)16-13(10)20/h8,11H,1-7,9H2,(H2,15,16,20,21)
InChIKeyGNLARQCOWMYBBG-UHFFFAOYSA-N
XLogP-0.35
TPSA89.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione with MolForge

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Related Compounds

2-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]benzoic acid
CID 56876211
1-[1-[(2,4-difluorophenyl)methyl]piperidin-4-yl]pyrrolidin-2-one
CID 74241962
1-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]pyrrolidin-2-one
CID 56872329
1-[1-[(2-cyclopentyloxyphenyl)methyl]piperidin-4-yl]pyrrolidin-2-one
CID 126771040
1-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]azepan-2-one
CID 134792490
1-[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]pyrrolidin-2-one
CID 122138464
1-[1-[(2-methylpyrimidin-4-yl)methyl]piperidin-4-yl]pyrrolidin-2-one
CID 126899404
1-cyclodecylpyrrolidin-2-one
CID 138507623
1-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]pyrrolidin-2-one
CID 126855901
1-[1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethyl)piperidin-4-yl]pyrrolidin-2-one
CID 126899394
azane;1-cyclohexylpyrrolidin-2-one
CID 172723863
5-[[(3S)-3-[4-(trifluoromethyl)benzoyl]piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione
CID 95221204

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione (CID 56880919) is 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione is O=C1CCCN1C1CCN(Cc2c[nH]c(=O)[nH]c2=O)CC1.
What is the InChIKey of 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione?
The InChIKey is GNLARQCOWMYBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c19-12-2-1-5-18(12)11-3-6-17(7-4-11)9-10-8-15-14(21)16-13(10)20/h8,11H,1-7,9H2,(H2,15,16,20,21).
What are the key properties of 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione?
5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione has a molecular weight of 292.34 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 56880919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).