6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione

C11H16N2O3 — CID 112601044

IUPAC6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
SMILESCc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C11H16N2O3/c1-7-8(14)12-10(16)13(9(7)15)11(2)5-3-4-6-11/h15H,3-6H2,1-2H3,(H,12,14,16)
InChIKeyHVNAVLKBHRLUDQ-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.84
Rot. Bonds1

About 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione

6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione (PubChem CID 112601044) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
PubChem CID112601044
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
SMILESCc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C11H16N2O3/c1-7-8(14)12-10(16)13(9(7)15)11(2)5-3-4-6-11/h15H,3-6H2,1-2H3,(H,12,14,16)
InChIKeyHVNAVLKBHRLUDQ-UHFFFAOYSA-N
XLogP0.84
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione (CID 112601044) is 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione is Cc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O.
What is the InChIKey of 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The InChIKey is HVNAVLKBHRLUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-7-8(14)12-10(16)13(9(7)15)11(2)5-3-4-6-11/h15H,3-6H2,1-2H3,(H,12,14,16).
What are the key properties of 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione has a molecular weight of 224.26 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione is sourced from PubChem (CID 112601044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).