N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide

C7H9N3O4 — CID 154210729

IUPACN-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide
SMILESCC(O)C(=O)Nc1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O4/c1-3(11)5(12)9-4-2-8-7(14)10-6(4)13/h2-3,11H,1H3,(H,9,12)(H2,8,10,13,14)
InChIKeyRQUVHTGPRLWZKQ-UHFFFAOYSA-N
MW199.17 g/mol
LogP-1.62
Rot. Bonds2

About N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide

N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide (PubChem CID 154210729) has the molecular formula C7H9N3O4 and a molecular weight of 199.17 g/mol. Its IUPAC name is N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide
PubChem CID154210729
Molecular FormulaC7H9N3O4
Molecular Weight199.17 g/mol
Exact Mass199.06
IUPAC NameN-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide
SMILESCC(O)C(=O)Nc1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O4/c1-3(11)5(12)9-4-2-8-7(14)10-6(4)13/h2-3,11H,1H3,(H,9,12)(H2,8,10,13,14)
InChIKeyRQUVHTGPRLWZKQ-UHFFFAOYSA-N
XLogP-1.62
TPSA115.05 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.17
LogP ≤ 5-1.62
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide?
The IUPAC name of N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide (CID 154210729) is N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide.
What is the SMILES notation for N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide?
The canonical SMILES for N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide is CC(O)C(=O)Nc1c[nH]c(=O)[nH]c1=O.
What is the InChIKey of N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide?
The InChIKey is RQUVHTGPRLWZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O4/c1-3(11)5(12)9-4-2-8-7(14)10-6(4)13/h2-3,11H,1H3,(H,9,12)(H2,8,10,13,14).
What are the key properties of N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide?
N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide has a molecular weight of 199.17 g/mol, XLogP of -1.62, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dioxo-1H-pyrimidin-5-yl)-2-hydroxypropanamide is sourced from PubChem (CID 154210729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).