N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide

C10H9N3O3 — CID 10751337

IUPACN-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1cnc2c(O)cccn2c1=O
InChIInChI=1S/C10H9N3O3/c1-6(14)12-7-5-11-9-8(15)3-2-4-13(9)10(7)16/h2-5,15H,1H3,(H,12,14)
InChIKeyRCEQXXZDNCXNNT-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.36
Rot. Bonds1

About N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide

N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide (PubChem CID 10751337) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide
PubChem CID10751337
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC NameN-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1cnc2c(O)cccn2c1=O
InChIInChI=1S/C10H9N3O3/c1-6(14)12-7-5-11-9-8(15)3-2-4-13(9)10(7)16/h2-5,15H,1H3,(H,12,14)
InChIKeyRCEQXXZDNCXNNT-UHFFFAOYSA-N
XLogP0.36
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide (CID 10751337) is N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide is CC(=O)Nc1cnc2c(O)cccn2c1=O.
What is the InChIKey of N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide?
The InChIKey is RCEQXXZDNCXNNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c1-6(14)12-7-5-11-9-8(15)3-2-4-13(9)10(7)16/h2-5,15H,1H3,(H,12,14).
What are the key properties of N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide?
N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide has a molecular weight of 219.20 g/mol, XLogP of 0.36, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 10751337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).