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

C12H18N2O3 — CID 112601046

IUPAC5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
SMILESCCc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C12H18N2O3/c1-3-8-9(15)13-11(17)14(10(8)16)12(2)6-4-5-7-12/h16H,3-7H2,1-2H3,(H,13,15,17)
InChIKeyXZPJMXBTSFNKGP-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.09
Rot. Bonds2

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

5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione (PubChem CID 112601046) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
PubChem CID112601046
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
SMILESCCc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C12H18N2O3/c1-3-8-9(15)13-11(17)14(10(8)16)12(2)6-4-5-7-12/h16H,3-7H2,1-2H3,(H,13,15,17)
InChIKeyXZPJMXBTSFNKGP-UHFFFAOYSA-N
XLogP1.09
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-hydroxy-5-methyl-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
CID 112601044
5-fluoro-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione
CID 112601041
5-fluoro-6-hydroxy-1-(1-methylcyclohexyl)pyrimidine-2,4-dione
CID 112600139
6-hydroxy-1-(1-methylcyclopentyl)-5-phenylpyrimidine-2,4-dione
CID 115948498
5-ethyl-6-hydroxy-1-[(2-methylthiolan-2-yl)methyl]pyrimidine-2,4-dione
CID 112601402
1-(cyclopentylmethyl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 112599268
5-ethyl-6-hydroxy-1-(2-methylprop-2-enyl)pyrimidine-2,4-dione
CID 114619425
5-ethyl-6-hydroxy-1-pentan-3-ylpyrimidine-2,4-dione
CID 112598462
1-(1,1-dioxothian-4-yl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 112599467
1-(1-cyclopropylethyl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 112599311
6-hydroxy-1-[(1-methylcyclopropyl)methyl]-5-propylpyrimidine-2,4-dione
CID 114102672
1-(3-cyclopentylpropyl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 106006233

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The IUPAC name of 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione (CID 112601046) is 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione.
What is the SMILES notation for 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The canonical SMILES for 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione is CCc1c(O)n(C2(C)CCCC2)c(=O)[nH]c1=O.
What is the InChIKey of 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
The InChIKey is XZPJMXBTSFNKGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-3-8-9(15)13-11(17)14(10(8)16)12(2)6-4-5-7-12/h16H,3-7H2,1-2H3,(H,13,15,17).
What are the key properties of 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione?
5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione has a molecular weight of 238.29 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-hydroxy-1-(1-methylcyclopentyl)pyrimidine-2,4-dione is sourced from PubChem (CID 112601046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).