N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide

C8H11N3O3 — CID 12778123

IUPACN-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide
SMILESCc1nc(NC(=O)CO)cc(=O)n1C
InChIInChI=1S/C8H11N3O3/c1-5-9-6(10-7(13)4-12)3-8(14)11(5)2/h3,12H,4H2,1-2H3,(H,10,13)
InChIKeyRWABLLAMMRKZKB-UHFFFAOYSA-N
MW197.19 g/mol
LogP-0.98
Rot. Bonds2

About N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide

N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide (PubChem CID 12778123) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide
PubChem CID12778123
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC NameN-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide
SMILESCc1nc(NC(=O)CO)cc(=O)n1C
InChIInChI=1S/C8H11N3O3/c1-5-9-6(10-7(13)4-12)3-8(14)11(5)2/h3,12H,4H2,1-2H3,(H,10,13)
InChIKeyRWABLLAMMRKZKB-UHFFFAOYSA-N
XLogP-0.98
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide?
The IUPAC name of N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide (CID 12778123) is N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide.
What is the SMILES notation for N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide?
The canonical SMILES for N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide is Cc1nc(NC(=O)CO)cc(=O)n1C.
What is the InChIKey of N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide?
The InChIKey is RWABLLAMMRKZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-5-9-6(10-7(13)4-12)3-8(14)11(5)2/h3,12H,4H2,1-2H3,(H,10,13).
What are the key properties of N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide?
N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide has a molecular weight of 197.19 g/mol, XLogP of -0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dimethyl-6-oxopyrimidin-4-yl)-2-hydroxyacetamide is sourced from PubChem (CID 12778123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).