5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione

C7H10N2O3 — CID 151283195

IUPAC5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione
SMILESCC(C)n1c(=O)[nH]cc(O)c1=O
InChIInChI=1S/C7H10N2O3/c1-4(2)9-6(11)5(10)3-8-7(9)12/h3-4,10H,1-2H3,(H,8,12)
InChIKeyNYVLRVGWVSFVIO-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.18
Rot. Bonds1

About 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione

5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione (PubChem CID 151283195) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione
PubChem CID151283195
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC Name5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione
SMILESCC(C)n1c(=O)[nH]cc(O)c1=O
InChIInChI=1S/C7H10N2O3/c1-4(2)9-6(11)5(10)3-8-7(9)12/h3-4,10H,1-2H3,(H,8,12)
InChIKeyNYVLRVGWVSFVIO-UHFFFAOYSA-N
XLogP-0.18
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione (CID 151283195) is 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione is CC(C)n1c(=O)[nH]cc(O)c1=O.
What is the InChIKey of 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione?
The InChIKey is NYVLRVGWVSFVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-4(2)9-6(11)5(10)3-8-7(9)12/h3-4,10H,1-2H3,(H,8,12).
What are the key properties of 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione?
5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione has a molecular weight of 170.17 g/mol, XLogP of -0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-propan-2-yl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 151283195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).