2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide

C10H8N2O4 — CID 139979677

IUPAC2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide
SMILESNC(=O)Cc1c(O)c2ccncc2oc1=O
InChIInChI=1S/C10H8N2O4/c11-8(13)3-6-9(14)5-1-2-12-4-7(5)16-10(6)15/h1-2,4,14H,3H2,(H2,11,13)
InChIKeyZHCXMLUSWCZEQQ-UHFFFAOYSA-N
MW220.18 g/mol
LogP-0.08
Rot. Bonds2

About 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide

2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide (PubChem CID 139979677) has the molecular formula C10H8N2O4 and a molecular weight of 220.18 g/mol. Its IUPAC name is 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide
PubChem CID139979677
Molecular FormulaC10H8N2O4
Molecular Weight220.18 g/mol
Exact Mass220.05
IUPAC Name2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide
SMILESNC(=O)Cc1c(O)c2ccncc2oc1=O
InChIInChI=1S/C10H8N2O4/c11-8(13)3-6-9(14)5-1-2-12-4-7(5)16-10(6)15/h1-2,4,14H,3H2,(H2,11,13)
InChIKeyZHCXMLUSWCZEQQ-UHFFFAOYSA-N
XLogP-0.08
TPSA106.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.18
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide?
The IUPAC name of 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide (CID 139979677) is 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide?
The canonical SMILES for 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide is NC(=O)Cc1c(O)c2ccncc2oc1=O.
What is the InChIKey of 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide?
The InChIKey is ZHCXMLUSWCZEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O4/c11-8(13)3-6-9(14)5-1-2-12-4-7(5)16-10(6)15/h1-2,4,14H,3H2,(H2,11,13).
What are the key properties of 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide?
2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide has a molecular weight of 220.18 g/mol, XLogP of -0.08, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-2-oxopyrano[2,3-c]pyridin-3-yl)acetamide is sourced from PubChem (CID 139979677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).