N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide

C14H11N3O3 — CID 135658749

IUPACN-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc3cnccc3o2)c(O)c1
InChIInChI=1S/C14H11N3O3/c1-8(18)16-9-2-3-10(12(19)6-9)14-17-11-7-15-5-4-13(11)20-14/h2-7,19H,1H3,(H,16,18)
InChIKeyWUPTVLRPLJVENG-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.55
Rot. Bonds2

About N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide

N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide (PubChem CID 135658749) has the molecular formula C14H11N3O3 and a molecular weight of 269.26 g/mol. Its IUPAC name is N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide
PubChem CID135658749
Molecular FormulaC14H11N3O3
Molecular Weight269.26 g/mol
Exact Mass269.08
IUPAC NameN-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc3cnccc3o2)c(O)c1
InChIInChI=1S/C14H11N3O3/c1-8(18)16-9-2-3-10(12(19)6-9)14-17-11-7-15-5-4-13(11)20-14/h2-7,19H,1H3,(H,16,18)
InChIKeyWUPTVLRPLJVENG-UHFFFAOYSA-N
XLogP2.55
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide?
The IUPAC name of N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide (CID 135658749) is N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide.
What is the SMILES notation for N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide?
The canonical SMILES for N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2nc3cnccc3o2)c(O)c1.
What is the InChIKey of N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide?
The InChIKey is WUPTVLRPLJVENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3/c1-8(18)16-9-2-3-10(12(19)6-9)14-17-11-7-15-5-4-13(11)20-14/h2-7,19H,1H3,(H,16,18).
What are the key properties of N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide?
N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide has a molecular weight of 269.26 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-hydroxy-4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]acetamide is sourced from PubChem (CID 135658749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).