N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide

C16H15N3O2 — CID 718603

IUPACN-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
SMILESCCC(=O)Nc1cccc(-c2nc3ncccc3o2)c1C
InChIInChI=1S/C16H15N3O2/c1-3-14(20)18-12-7-4-6-11(10(12)2)16-19-15-13(21-16)8-5-9-17-15/h4-9H,3H2,1-2H3,(H,18,20)
InChIKeyPIOIYNGCXQCBOB-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.55
Rot. Bonds3

About N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide

N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide (PubChem CID 718603) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide.

Molecular Properties

Compound NameN-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
PubChem CID718603
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
SMILESCCC(=O)Nc1cccc(-c2nc3ncccc3o2)c1C
InChIInChI=1S/C16H15N3O2/c1-3-14(20)18-12-7-4-6-11(10(12)2)16-19-15-13(21-16)8-5-9-17-15/h4-9H,3H2,1-2H3,(H,18,20)
InChIKeyPIOIYNGCXQCBOB-UHFFFAOYSA-N
XLogP3.55
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide?
The IUPAC name of N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide (CID 718603) is N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide.
What is the SMILES notation for N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide?
The canonical SMILES for N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide is CCC(=O)Nc1cccc(-c2nc3ncccc3o2)c1C.
What is the InChIKey of N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide?
The InChIKey is PIOIYNGCXQCBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-3-14(20)18-12-7-4-6-11(10(12)2)16-19-15-13(21-16)8-5-9-17-15/h4-9H,3H2,1-2H3,(H,18,20).
What are the key properties of N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide?
N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide has a molecular weight of 281.31 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide is sourced from PubChem (CID 718603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).