2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide

C11H17N3O3 — CID 43501149

IUPAC2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide
SMILESCc1nc(=O)[nH]c(C)c1CC(=O)NCC(C)O
InChIInChI=1S/C11H17N3O3/c1-6(15)5-12-10(16)4-9-7(2)13-11(17)14-8(9)3/h6,15H,4-5H2,1-3H3,(H,12,16)(H,13,14,17)
InChIKeyOFZHMUXHFDDVPY-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.57
Rot. Bonds4

About 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide

2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide (PubChem CID 43501149) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide
PubChem CID43501149
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide
SMILESCc1nc(=O)[nH]c(C)c1CC(=O)NCC(C)O
InChIInChI=1S/C11H17N3O3/c1-6(15)5-12-10(16)4-9-7(2)13-11(17)14-8(9)3/h6,15H,4-5H2,1-3H3,(H,12,16)(H,13,14,17)
InChIKeyOFZHMUXHFDDVPY-UHFFFAOYSA-N
XLogP-0.57
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide?
The IUPAC name of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide (CID 43501149) is 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide?
The canonical SMILES for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide is Cc1nc(=O)[nH]c(C)c1CC(=O)NCC(C)O.
What is the InChIKey of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide?
The InChIKey is OFZHMUXHFDDVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-6(15)5-12-10(16)4-9-7(2)13-11(17)14-8(9)3/h6,15H,4-5H2,1-3H3,(H,12,16)(H,13,14,17).
What are the key properties of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide?
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide has a molecular weight of 239.27 g/mol, XLogP of -0.57, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-hydroxypropyl)acetamide is sourced from PubChem (CID 43501149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).