N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide

C8H11N3O3 — CID 63770067

IUPACN-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cnccc1=O)NCCO
InChIInChI=1S/C8H11N3O3/c12-4-3-10-7(13)5-11-6-9-2-1-8(11)14/h1-2,6,12H,3-5H2,(H,10,13)
InChIKeyKACJPNCGFAIDIR-UHFFFAOYSA-N
MW197.19 g/mol
LogP-1.65
Rot. Bonds4

About N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide

N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide (PubChem CID 63770067) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide
PubChem CID63770067
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC NameN-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cnccc1=O)NCCO
InChIInChI=1S/C8H11N3O3/c12-4-3-10-7(13)5-11-6-9-2-1-8(11)14/h1-2,6,12H,3-5H2,(H,10,13)
InChIKeyKACJPNCGFAIDIR-UHFFFAOYSA-N
XLogP-1.65
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-1.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide (CID 63770067) is N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide is O=C(Cn1cnccc1=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The InChIKey is KACJPNCGFAIDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c12-4-3-10-7(13)5-11-6-9-2-1-8(11)14/h1-2,6,12H,3-5H2,(H,10,13).
What are the key properties of N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide?
N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide has a molecular weight of 197.19 g/mol, XLogP of -1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 63770067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).