4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one

C10H14N2O3 — CID 82838314

IUPAC4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one
SMILESCc1c(O)nc(C2CCC(C)O2)[nH]c1=O
InChIInChI=1S/C10H14N2O3/c1-5-3-4-7(15-5)8-11-9(13)6(2)10(14)12-8/h5,7H,3-4H2,1-2H3,(H2,11,12,13,14)
InChIKeyYETMKOLRPLAQRU-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.02
Rot. Bonds1

About 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one

4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one (PubChem CID 82838314) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one
PubChem CID82838314
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one
SMILESCc1c(O)nc(C2CCC(C)O2)[nH]c1=O
InChIInChI=1S/C10H14N2O3/c1-5-3-4-7(15-5)8-11-9(13)6(2)10(14)12-8/h5,7H,3-4H2,1-2H3,(H2,11,12,13,14)
InChIKeyYETMKOLRPLAQRU-UHFFFAOYSA-N
XLogP1.02
TPSA75.21 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 ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one (CID 82838314) is 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one is Cc1c(O)nc(C2CCC(C)O2)[nH]c1=O.
What is the InChIKey of 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one?
The InChIKey is YETMKOLRPLAQRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-5-3-4-7(15-5)8-11-9(13)6(2)10(14)12-8/h5,7H,3-4H2,1-2H3,(H2,11,12,13,14).
What are the key properties of 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one?
4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one has a molecular weight of 210.23 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-methyl-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 82838314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).