1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione

C10H14N2O3 — CID 10443092

IUPAC1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione
SMILESCc1cn([C@H]2CC[C@@H](O)C2)c(=O)[nH]c1=O
InChIInChI=1S/C10H14N2O3/c1-6-5-12(10(15)11-9(6)14)7-2-3-8(13)4-7/h5,7-8,13H,2-4H2,1H3,(H,11,14,15)/t7-,8+/m0/s1
InChIKeyKIJFCOLLMXGQKU-JGVFFNPUSA-N
MW210.23 g/mol
LogP-0.07
Rot. Bonds1

About 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione

1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione (PubChem CID 10443092) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione
PubChem CID10443092
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione
SMILESCc1cn([C@H]2CC[C@@H](O)C2)c(=O)[nH]c1=O
InChIInChI=1S/C10H14N2O3/c1-6-5-12(10(15)11-9(6)14)7-2-3-8(13)4-7/h5,7-8,13H,2-4H2,1H3,(H,11,14,15)/t7-,8+/m0/s1
InChIKeyKIJFCOLLMXGQKU-JGVFFNPUSA-N
XLogP-0.07
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S,5R)-5-hydroxypiperidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 51050699
1-[(2R)-4,5-dihydroxyoxan-2-yl]-5-methylpyrimidine-2,4-dione
CID 25134798
1-[(2R,4S,5R)-4,5-dihydroxyoxan-2-yl]-5-methylpyrimidine-2,4-dione
CID 14079545
1-[(2R,4S,5S)-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 1277936
5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione
CID 51050595
1-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 12068040
1-[(1R,3S,4R)-3-methoxy-4-(methoxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
CID 122493318
1-[(1R,3S,4S)-3-amino-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
CID 14097532
1-[3-amino-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
CID 14097531
1-[(4R)-4-hydroxypyrrolidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 138975124
1-[(1R,4R)-3-(18F)fluoro-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
CID 158344832
1-[(3S,4S)-1-cyclohexyl-4-hydroxypyrrolidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 133065275

Frequently Asked Questions

What is the IUPAC name of 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione?
The IUPAC name of 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione (CID 10443092) is 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione.
What is the SMILES notation for 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione?
The canonical SMILES for 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione is Cc1cn([C@H]2CC[C@@H](O)C2)c(=O)[nH]c1=O.
What is the InChIKey of 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione?
The InChIKey is KIJFCOLLMXGQKU-JGVFFNPUSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-5-12(10(15)11-9(6)14)7-2-3-8(13)4-7/h5,7-8,13H,2-4H2,1H3,(H,11,14,15)/t7-,8+/m0/s1.
What are the key properties of 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione?
1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione has a molecular weight of 210.23 g/mol, XLogP of -0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione is sourced from PubChem (CID 10443092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).